Government Scientific Source

$0~$10(0)
$10~$25(1)
$25~$50(22)
$50~$75(22)
$75~$100(20)
$100~$200(48)
$200~$300(25)
$300~$400(5)
$400~$500(7)
$500~$750(11)
$750~$1000(4)
$1000~$5000(7)
$5000~$10000(0)
$10000~$50000(0)
$50000~$100000(0)
$100000~$3000000(0)

Assay Percent Range

>=98%

>=99%

98.5% min. (GC)

94% min. (GC)

90%

99%

99% min. (GC)

99+%

95% min. (GC)

96% min. (GC)

97.5% min. (GC)

98%

Beilstein Reference

01, 134

01, 171

01,172

05, 19

1697175

01, 159

01, 172

01, 217

01,226

05, 406

05, 453

1560168

1696875

635760

01, 174

01, IV, 487

05, 280

05, III, 245

05,431

1849832

605461

Applications

gas chromatography (GC): suitable

Boiling Point

215.0°C to 217.0°C

261°C to 263°C

30.0°C

315°C

62.0°C to 65.0°C

125°C to 126°C

126°C

142°C to 144°C

150°C to 152°C

187.0°C

215°C to 217°C

220.0°C (30.0 mmHg)

227.0°C

263°C

41.0°C

81°C to 82°C

90°C

98°C

114°C to 115°C

125.0°C to 127.0°C

145.0°C to 146.0°C

151°C

163.0°C to 166.0°C

168.0°C

241°C

270.0°C

279 C (lit.)

287.0°C

30.0°C

323-326 C (lit.)

50.0°C

67.0°C

80.0°C

Boiling Range

94.5° to 99.0°C (202.1°F to 210.20°F)

Autoignition Temp

541 °F

CAS Registry Number 1

108-87-2

111-67-1

112-40-3

13475-82-6

1541-23-7

1849-27-0

3070-53-9

308068-56-6

259-79-0

3452-07-1

536-74-3

558-37-2

592-41-6

592-57-4

108-67-8

111-78-4

111-84-2

112-88-9

1120-21-4

13269-52-8

7642-04-8

78-78-4

142-82-5

4313-57-9

91-17-8

91-57-6

928-49-4

4045-44-7

575-41-7

826-74-4

108-88-3

111-65-9

112-95-8

92-51-3

95-63-6

287-92-3

544-76-3

Assayn Heptane

99.0% min.

CAS RN 1 Max Percentage

100.0

CAS RN 1 Min Percentage

98.5

96.0

97.5

99.0

94.0

95.0

CAS_NO

111-46-6

1120-21-4

118-74-1

118712-89-3

1309573-60-1

1694-31-1

19044-88-3

107-31-3

108-90-7

109-69-3

287-92-3

298-02-2

121-45-9

32315-10-9

16940-66-2

628-16-0

16853-85-3

3886-69-9

78-78-4

106-40-1

124-18-5

CASRN1 Min Percentage

98.5

CASRN1 Max Percentage

100

ChEBI

CHEBI:17578

CHEBI:45296

CHEBI:34833

CHEBI:38853

CHEBI:17590

CHEBI:23492

CHEBI:28817

CHEBI:30362

CHEBI:30824

Chemical Name or Material

2-Methylbutane

1-Octadecene

Decahydronaphthalene

Cyclopentane

1,4-Bis(phenylethynyl)benzene

n-Hexadecane

n-Octane

n-Dodecane

Toluene

Chemical Substance ID

24846426

24852740

329764252

329770160

57648659

Color

Colorless

White-Yellow

Colorless to Yellow

Colorless to Amber

Undesignated

COLOR

Yellow

White

Density

0.7500g/mL

0.8600g/mL

0.7080g/mL

0.7730g/mL

0.7890g/mL

0.8900g/mL

0.703

0.749

Density

0.7530g/mL

0.8800g/mL

0.6200g/mL

DOT Information

Transport Hazard Class: 3; Packing Group: III; Proper Shipping Name: HYDROCARBONS, LIQUID, N.O.S.

Transport Hazard Class: 3; Packing Group: II; Proper Shipping Name: OCTANES

EINECS Number

(2)-0024

(4)-0655

201-142-8

203-892-1

202-046-9

208-878-9

203-967-9

204-012-9

206-016-6

EC Number

203-393-9

203-872-2

241-004-4

223-423-4

Flash Point

-51°C

154°C

15°C (59°F)

44°C

71°C

71°C (159°F)

-7°C

135°C

58°C

Form

neat

Empirical Formula

HCl

Formula

HC≡CCH₂CH₂C≡CH

(HOCH₂CH₂)₂O

Formula Weight

114.23

120.19

278.36

72.15

170.34

252.48

112.22

136.24

138.25

70.15

84.16

92.14

96.17

Formula Weight

36.46

226.44

Grade

HPLC

OPTIMA

Pure

Technical

analytical standard

for GC derivatization

Extra Dry

Extra Pure

H-Codes

H225-H290-H319-H336

H225-H314

H300 + H310 + H330-H315-H317-H318-H341-H410

H315-H331-H410

H302 + H312 + H332 - H373

H302 + H332-H315-H319

H317 - H318 - H330 - H335 - H351 - H410

H300 + H310 + H330-H317-H400

H302-H412

H315-H317-H332-H335-H340-H360FD-H410

H319-H400

H350-H372-H410

H300 + H310 + H330 - H410

H410

Health Hazard 1

Danger

H225-H304-H315-H319-H336

H226

H226-H302+H312+H332-H315-H319-H335

H226-H304-H315-H319

H225-H304-H315-H319-H336-H361d-H373

H225-H304-H319

H226-H304-H315-H319-H335-H336

H228-H315-H319-H335

H304

GHS Signal Word: Danger

GHS Signal Word: Warning

SIGNAL WORD: DANGER!

H227-H304

Health Hazard 2

GHS H Statement:
Harmful if swallowed.
May be fatal if swallowed and enters airways.
Highly flammable liquid and vapor.

GHS H Statement:
May be fatal if swallowed and enters airways.
Repeated exposure may cause skin dryness or cracking.

GHS H Statement:
May cause drowsiness or dizziness.
May be fatal if swallowed and enters airways.
Causes skin irritation.
Toxic to aquatic life with long lasting effects.
Highly flammable liquid and vapor.

GHS H Statement
H304-H226-H319-H335
May be fatal if swallowed and enters airways.
Flammable liquid and vapour.
Causes serious eye irritation.
May cause respiratory irritation.

GHS H Statement
H304-H226-H332
May be fatal if swallowed and enters airways.
Flammable liquid and vapour.
Harmful if inhaled.

GHS H Statement
Causes skin irritation.
Very toxic to aquatic life with long lasting effects.
May cause drowsiness or dizziness.
May be fatal if swallowed and enters airways.
Highly flammable liquid and vapor.

GHS H Statement
Flammable liquid and vapor.
Harmful if swallowed.
Harmful if inhaled.
May be fatal if swallowed and enters airways.
Toxic to aquatic life with long lasting effects.

GHS H Statement
H228-H315-H319-H335
Flammable solid.
Causes skin irritation.
Causes serious eye irritation.
May cause respiratory irritation.

GHS H Statement
H304-H226-H319-H335
May be fatal if swallowed and enters airways.
Flammable liquid and vapor.
Causes serious eye irritation.
May cause respiratory irritation.

GHS H Statement
Highly flammable liquid and vapor.
Causes skin irritation.
May be fatal if swallowed and enters airways.
Causes serious eye irritation.
May cause respiratory irritation.

GHS H Statement
Very toxic to aquatic life with long lasting effects.
Flammable liquid and vapor.
May be fatal if swallowed and enters airways.

GHS P Statement May cause drowsiness or dizziness. May cause damage to organs through prolonged or repeated exposure if inhaled. May be fatal if swallowed and enters airways. Causes skin irritation. Suspected of damag

GHS P Statement
May be fatal if swallowed and enters airways.
Repeated exposure may cause skin dryness or cracking.

GHS H Statement:
May cause drowsiness or dizziness.
Toxic to aquatic life with long lasting effects.
May be fatal if swallowed and enters airways.
Extremely flammable liquid and vapor.
Repeated exposure may cause skin dryness o

GHS H Statement:
Toxic to aquatic life with long lasting effects.

GHS H Statement
Causes serious eye irritation.
May cause respiratory irritation.
May cause an allergic skin reaction.

GHS H Statement
Causes skin irritation.
Harmful if inhaled.
Toxic to aquatic life with long lasting effects.
Causes serious eye irritation.
May cause respiratory irritation.
Flammable liquid and vapor.

DANGER!

GHS H Statement:
Causes skin irritation.
Harmful if swallowed.
May be fatal if swallowed and enters airways.
May cause respiratory irritation.
Causes serious eye irritation.
Highly flammable liquid and vapor.

GHS H Statement
Highly flammable liquid and vapor.
May be fatal if swallowed and enters airways.
May cause drowsiness or dizziness.
Harmful to aquatic life with long lasting effects.

GHS H Statement
May be fatal if swallowed and enters airways.
Repeated exposure may cause skin dryness or cracking.

GHS H Statement:
May be fatal if swallowed and enters airways.
Flammable liquid and vapor.
Repeated exposure may cause skin dryness or cracking.

GHS H Statement
H225-H304-H315-H336
Highly flammable liquid and vapour.
May be fatal if swallowed and enters airways.
Causes skin irritation.
May cause drowsiness or dizziness.

GHS H Statement
Causes severe skin burns and eye damage.
Toxic if inhaled.
May be fatal if swallowed and enters airways.
Very toxic to aquatic life with long lasting effects.
Flammable liquid and vapor.

GHS H Statement
Flammable liquid and vapor.
May be fatal if swallowed and enters airways.
Repeated exposure may cause skin dryness or cracking.

GHS H Statement
Flammable liquid and vapour.
May be fatal if swallowed and enters airways.
Causes skin irritation.
Causes serious eye irritation.
May cause respiratory irritation.
May cause drowsiness or dizziness.

GHS H Statement
Highly flammable liquid and vapor.
May be fatal if swallowed and enters airways.
Repeated exposure may cause skin dryness or cracking.

GHS H Statement
Highly flammable liquid and vapor.
May cause respiratory irritation.

GHS H Statement
H225-H304-H319
Highly flammable liquid and vapour.
May be fatal if swallowed and enters airways.
Causes serious eye irritation.

GHS H Statement
H226
Flammable liquid and vapor.

GHS H Statement
Flammable solid.
Very toxic to aquatic life with long lasting effects.

GHS H Statement
May be fatal if swallowed and enters airways.

GHS H Statement
May be fatal if swallowed and enters airways.
Harmful if inhaled.
Harmful if swallowed.
May cause damage to organs.
Repeated exposure may cause skin dryness or cracking.

GHS H Statement
May cause drowsiness or dizziness.
Toxic to aquatic life with long lasting effects.
May be fatal if swallowed and enters airways.
Extremely flammable liquid and vapor.
Repeated exposure may cause skin drynes

Health Hazard 3

GHS P Statement:
IF SWALLOWED: Immediately call a POISON CENTRE or doctor/physician.
Do NOT induce vomiting.
IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell.
Keep away from heat/sparks/open flames/hot surf

GHS P Statement
Avoid breathing dust/fume/gas/mist/vapors/spray.
IF SWALLOWED: Immediately call a POISON CENTRE or doctor/physician.
Do NOT induce vomiting.
Avoid release to the environment.
IF ON SKIN: Wash with plenty of soap

GHS P Statement
IF SWALLOWED: rinse mouth.
Do NOT induce vomiting.
Wash face,hands and any exposed skin thoroughly after handling.
IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
Do NOT induce vomiting.
I

GHS P Statement
Keep away from heat/sparks/open flames/hot surfaces.
- No smoking.
IF ON SKIN (or hair): Take off immediately all contaminated clothing.
Rinse skin with water/shower.
IF SWALLOWED: Immediately call a POISON CENTER o

P201-P202-P210-P233-P235-P240-P241-P242-P243-P260-P264b-P271-P280i-P281-P301+P310-P303+P361+P353-P304+P340-P305+P351+P338-P308+P313-P331-P332+P313-P363-P370+P378q-P501c

P210-P280-P301+P310-P331-P370+P378q-P501c

P301+P310-P331-P501c

Emergency Overview
Combustible liquid. Harmful by inhalation. Aspiration hazard if swallowed - can enter lungs and cause damage. Repeated exposure may cause skin dryness or cracking.
NFPA

GHS P Statement:
Avoid release to the environment.

WARNING: The information provided on this web site was developed in compliance with European Union (EU) regulations and is correct to the best of our knowledge, information and

GHS P Statement:
IF SWALLOWED: Immediately call a POISON CENTRE or doctor/physician.
Do NOT induce vomiting.
Wear protective gloves/protective clothing/eye protection/face protection.

WARNING: The information provided o

GHS P Statement
Avoid breathing dust/fume/gas/mist/vapors/spray.
IF SWALLOWED: Immediately call a POISON CENTRE or doctor/physician.
Do NOT induce vomiting.
IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell.<

GHS P Statement
IF SWALLOWED: Immediately call a POISON CENTRE or doctor/physician.
Do NOT induce vomiting.

GHS P Statement
Keep away from heat/sparks/open flames/hot surfaces.
- No smoking.
IF ON SKIN: Wash with plenty of soap and water.
IF IN EYES: Rinse cautiously with water for several minutes.
Remove contact lenses,if present and ea

GHS P Statement
Wear protective gloves/protective clothing/eye protection/face protection.
IF IN EYES: Rinse cautiously with water for several minutes.
Remove contact lenses,if present and easy to do.
Continue rinsing.

P210-P233-P235-P240-P241-P242-P243-P261-P264b-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P312-P330-P332+P313-P362-P370+P378q-P374-P380-P501c

P210-P233-P235-P240-P241-P242-P243-P261-P264b-P271-P280-P301+P310-P303+P361+P353-P304+P340-P305+P351+P338-P312-P331-P332+P313-P363-P370+P378q-P501c

P210-P233-P240-P241-P242-P243-P264b-P280-P301+P310-P303+P361+P353-P305+P351+P338-P331-P370+P378q-P501c

P210-P233-P240-P241-P242-P243-P280-P303+P361+P353-P370+P378q-P501c

P210-P240-P241-P261-P264b-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P362-P370+P378q-P501c

GHS P Statement:
Avoid breathing dust/fume/gas/mist/vapors/spray.
IF SWALLOWED: Immediately call a POISON CENTRE or doctor/physician.
Do NOT induce vomiting.
Avoid release to the environment.
IF ON SKIN: Wash with plenty of soa

GHS P Statement:
Avoid breathing dust/fume/gas/mist/vapors/spray.
IF SWALLOWED: Immediately call a POISON CENTRE or doctor/physician.
Do NOT induce vomiting.
IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell

GHS P Statement:
IF SWALLOWED: Immediately call a POISON CENTRE or doctor/physician.
Do NOT induce vomiting.

WARNING: The information provided on this web site was developed in compliance with European Union (EU) regulation

GHS P Statement
IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
Do NOT induce vomiting.

GHS P Statement
Keep away from heat/sparks/open flames/hot surfaces.
- No smoking.
Avoid breathing dust/fume/gas/mist/vapors/spray.
IF ON SKIN (or hair): Take off immediately all contaminated clothing.
Rinse skin with water/shower.

GHS P Statement
Keep away from heat/sparks/open flames/hot surfaces.
- No smoking.
Avoid release to the environment.

GHS P Statement
Keep away from heat/sparks/open flames/hot surfaces.
- No smoking.
IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
Do NOT induce vomiting.
IF INHALED: Remove to fresh air and keep at rest in a

Emergency Overview
Flammable liquid and vapor. Inhalation may cause central nervous system effects. May cause irritation of respiratory tract. Aspiration hazard if swallowed - can enter lungs and cause damage. Very toxic to aquatic organisms,

Emergency Overview
Flammable liquid and vapor. Causes eye, skin, and respiratory tract irritation. Vapors may cause drowsiness and dizziness. Aspiration hazard if swallowed - can enter lungs and cause damage. Danger of serious damage to health

GHS P Statement:
Immediately call a POISON CENTER or doctor/physician.
IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing.
IF SWALLOWED: Immediately call a POISON CENTRE or doctor/physician.

GHS P Statement
Avoid breathing dust/fume/gas/mist/vapors/spray.
Avoid release to the environment.
IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing.
IF ON SKIN: Wash with plenty of soap

GHS P Statement
Avoid release to the environment.
Keep away from heat/sparks/open flames/hot surfaces.
- No smoking.
IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
Do NOT induce vomiting.
Store in a well

GHS P Statement
IF SWALLOWED: Immediately call a POISON CENTRE or doctor/physician.

GHS P Statement
Keep away from heat/sparks/open flames/hot surfaces.
- No smoking.
Take precautionary measures against static discharge.
Wear protective gloves/protective clothing/eye protection/face protection.
IF SWALLOWED: Imm

P210-P233-P240-P241-P242-P243-P264b-P280-P301+P310-P303+P361+P353-P305+P351+P338-P331-P332+P313-P363-P370+P378q-P501c

Identification

Pass Test

InChIKey

CBFCDTFDPHXCNY-UHFFFAOYSA-N

IGGDKDTUCAWDAN-UHFFFAOYSA-N

LIKMAJRDDDTEIG-UHFFFAOYSA-N

LPSXSORODABQKT-FIRGSJFUSA-N

PKXHXOTZMFCXSH-UHFFFAOYSA-N

QDXQAOGNBCOEQX-UHFFFAOYSA-N

TVMXDCGIABBOFY-UHFFFAOYSA-N

URYYVOIYTNXXBN-UPHRSURJSA-N

VNWKTOKETHGBQD-UHFFFAOYSA-N

VYXHVRARDIDEHS-HASIUUCGSA-N

WVIIMZNLDWSIRH-UHFFFAOYSA-N

CDKDZKXSXLNROY-UHFFFAOYSA-N

DQQNMIPXXNPGCV-UHFFFAOYSA-N

GEAWFZNTIFJMHR-UHFFFAOYSA-N

GWHJZXXIDMPWGX-UHFFFAOYSA-N

BKIMMITUMNQMOS-UHFFFAOYSA-N

DCAYPVUWAIABOU-UHFFFAOYSA-N

QIMMUPPBPVKWKM-UHFFFAOYSA-N

QWTDNUCVQCZILF-UHFFFAOYSA-N

RSJKGSCJYJTIGS-UHFFFAOYSA-N

ILPBINAXDRFYPL-HWKANZROSA-N

IMNFDUFMRHMDMM-UHFFFAOYSA-N

VAMFXQBUQXONLZ-UHFFFAOYSA-N

VCLJODPNBNEBKW-UHFFFAOYNA-N

VKPSKYDESGTTFR-UHFFFAOYSA-N

LPSXSORODABQKT-AATLWQCWSA-N

MVLGANVFCMOJHR-UHFFFAOYSA-N

ZGXMNEKDFYUNDQ-GQCTYLIASA-N

OOLUVSIJOMLOCB-UHFFFAOYSA-N

QHJMFSMPSZREIF-UHFFFAOYSA-N

UAEPNZWRGJTJPN-UHFFFAOYSA-N

UEXCJVNBTNXOEH-UHFFFAOYSA-N

AUHZEENZYGFFBQ-UHFFFAOYSA-N

CCCMONHAUSKTEQ-UHFFFAOYSA-N

ZQDPJFUHLCOCRG-AATRIKPKSA-N

FPVSTPLZJLYNMB-UHFFFAOYSA-N

IFVTZJHWGZSXFD-UHFFFAOYSA-N

KSZVOXHGCKKOLL-UHFFFAOYSA-N

MGNZXYYWBUKAII-UHFFFAOYSA-N

NNBZCPXTIHJBJL-UHFFFAOYSA-N

RGSFGYAAUTVSQA-UHFFFAOYSA-N

SNRUBQQJIBEYMU-UHFFFAOYSA-N

SQNZJJAZBFDUTD-UHFFFAOYSA-N

WQIQNKQYEUMPBM-UHFFFAOYSA-N

YCOZIPAWZNQLMR-UHFFFAOYSA-N

YXFVVABEGXRONW-UHFFFAOYSA-N

Infrared Spectrum

Authentic

IUPAC Name

(5Z)-cycloocta-1,5-diene

(E)-hex-3-ene

1,2,4-trimethylbenzene

1,4-diethynylbenzene

1-ethynyl-4-methylbenzene

2-methylbutane

cyclopentane

hex-3-yne

toluene

(5E)-hepta-1,5-diene

1,2,4,5-tetramethylbenzene

1,4-bis(2-phenylethynyl)benzene

2,2,4,4,6,8,8-heptamethylnonane

cyclohexylcyclohexane

cyclooctene

hepta-1,6-diene

heptane

icos-1-ene

methane

(E)-oct-2-ene

1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene

1,3,5-trimethylbenzene

1,3-dimethylnaphthalene

2-methylnaphthalene

1,2,3,4,5-pentamethylcyclopenta-1,3-diene

cyclohexa-1,3-diene

1-ethenylnaphthalene

dodecane

1-methylcyclohexa-1,4-diene

2,2,4,6,6-pentamethylheptane

methylcyclohexane

octadec-1-ene

octylbenzene

3,3-dimethylbut-1-ene

biphenylene

ethynylbenzene

hex-1-ene

hexadecane

icosane

nonane

octane

pentadecane

undecane

IOD-Codes

F,Xi

T+,N

T,N

Xi,N

Linear Formula

(CH3)3CCH2CH(CH3)CH2C(CH3)2CH2C(CH3)3

C10H6(CH3)2

C15H12Cl2F4O2

C2H5CH=CHC2H5

C4H7Cl2O4P

C6H11CH3

C6H2(CH3)4

C6H4(C∽CH)2

C6H5CH3

C7H17O2PS3

CH3(CH2)13CH3

CH3(CH2)3CH=CH2

C11H11NO

C7H6N2O5

C8H14

CH3(CH2)10CH3

CH3(CH2)7CH3

O2NC6H4OH

C₂H₅CH(CH₃)₂

C10H18

C12H18N4O6S

C17H21ClN2O2S

C5H10

C6Cl6

C6H5(CH2)7CH3

C8Cl4N2

CH₃(CH₂)₆CH₃

CH3(CH2)14CH3

CH3CH2C∽CCH2CH3

HCl · CH3CH2OH

(CH3)3CCH=CH2

C10H19N5S

C12H14ClNO2

C14H18N4O3

C2H5CH(CH3)2

C6H3(CH3)3

CH₃(CH₂)₉CH₃

CH3(CH2)15CH=CH2

CH3(CH2)18CH3

CH3(CH2)5CH3

CH3(CH2)6CH3

HCl · CH3CH(OH)CH3

MDL Number

MFCD00007331

MFCD00008160

MFCD00008303

MFCD00008811

MFCD00009199

MFCD00009531

MFCD00011444

MFCD00036234

MFCD00074742

MFCD12545951

MFCD00001356

MFCD00003518

MFCD00008350

MFCD00008986

MFCD00009002

MFCD00009338

MFCD00011312

MFCD00011646

MFCD00014924

MFCD00036348

MFCD00043143

MFCD00062848

MFCD00064405

MFCD00066257

MFCD00078725

MFCD00091518

MFCD00128025

MFCD00151408

MFCD00191398

MFCD00000409

MFCD00000497

MFCD00000530

MFCD00001009

MFCD00002882

MFCD00007105

MFCD00007822

MFCD00008959

MFCD00009354

MFCD00009355

MFCD00009538

MFCD00009577

MFCD00013189

MFCD00015910

MFCD00036123

MFCD00045594

MFCD00064272

MFCD28054469

MFCD00137385

MFCD00000540

MFCD00003291

MFCD00003471

MFCD00662883

MFCD00008495

MFCD00008954

MFCD00009246

MFCD00011075

MFCD00011324

MFCD00011357

MFCD00011747

MFCD00012429

MFCD00013808

MFCD00072457

MFCD00084636

MFCD23704393

Melting Point

-115.0°C

-129°C

-140.0°C

-160.0°C

-45.0°C

-94.0°C

-98.0°C

36.0°C to 38.0°C

75°C

-113.0°C

-12.0°C

-126.3°C

-26.0°C

-45°C

-57.0°C

-69.5°C

-91°C

°C to 93°C

285.0°C to 288.0°C

-36°C

-44.0°C

-53°C

-60.0°C

-95.0°C

~21°C

109°C to 112°C

17.5°C

3.0°C to 4.0°C

78.0°C to 82.0°C

-10°C

-16.0°C

-31.0°C

-5°C

-57.0°C

-57°C

15°C to 17°C

176°C to 178°C

18.0°C

9.9°C

94°C to 98°C

Merck Index Reference

14,6749

15, 5977

15, 6838

15,3515

15,6838

15,8023

14,3861

15, 9688

15, 2736

15, 2730

15, 2850

15, 6118

MFCD Number

MFCD00001532

MFCD00001752

MFCD00008512

MFCD00008527

MFCD00008538

MFCD00008853

MFCD00008959

MFCD00008969

MFCD00008998

MFCD00009013

MFCD00009338

MFCD00009344

MFCD00009505

MFCD00009556

MFCD00075766

MFCD00001356

MFCD00001497

MFCD00009381

MFCD00009564

MFCD00151408

MFCD00001110

MFCD00001354

MFCD00003815

MFCD00004130

MFCD00008571

MFCD00008856

MFCD00008990

MFCD00026998

MFCD00001538

MFCD01714931

MFCD00004036

MFCD00004118

MFCD00008570

MFCD00008667

MFCD00009003

MFCD00009532

MFCD00009574

MFCD00065146

MFCD00074748

MFCD00078375

MFCD00160829

Molecular Formula

C10H14

C10H6

C12H12

C12H26

C14H22

C20H42

C22H14

C7H12

C7H14

C8H14

C8H16

C₁₆H₁₆

C₈H₁₈

C10H16

C10H18

C11H10

C11H24

C12H8

C16H34

C18H36

C20H40

C5H10

C6H12

C7H16

C8H18

C8H6

C₅H₁₂

C7H8

C9H12

C₈H₁₂

C12H10

C12H22

C15H32

C5H12

C6H10

C6H8

C7H10

C9H20

C9H8

CH4

Molecular Weight

0.0

108.18

112.216

112.56

114.23

147.19

152.2

172.02

173.21

241.36

252.486

274.39

274.40

278.354

296.75

34.08

371.15

72.15

75.97

76.09

82.15

84.16

92.57

98.19

102.136

104.10

106.12

110.2

114.232

121.18

128.259

142.201

158.24

16.043

164.21

166.31

170.34

212.42

220.98

252.48

260.38

282.54

346.36

352.88

36.46

40.11

72.151

80.13

84.15

100.205

120.195

122.02

126.16

130.14

138.25

139.11

154.212

156.23

164.10

166.24

179.20

190.33

198.13

208.3

239.70

24.00

250.52

142.3

265.91

104.15

274.86

120.19

295.18

134.22

136.238

156.313

158.19

200.08

45.08

226.44

60.05

233.09

622.18

70.15

261.46

94.157

96.173

280.54

284.78

290.32

37.95

74.12

85.94

92.141

Molecular Weight

112.22

116.163

124.08

37.83

>300 C (lit.)

106-109 C

110-115 C (lit.)

227-229 C (lit.)

Name Note

95%

99%

Mixture of cis and trans

96%

99+%

Extra Dry

Multi-walled, OD: <=8nm, ID: 2 to 5nm, 0.5 to 2 micron long

Stabilized

stabilized with 0.01% BHT

97%

Odor

Nearly odorless

Light

Pungent

Characteristic

P-CODES

P273 - P391 - P501

P273-P280-P305 + P351 + P338-P337 + P313-P391

Missing Phrase - N15.00950417-P260-P280-P302 + P352 + P310-P304 + P340 + P310-P305 + P351 + P338 + P310

P260-P262-P273-P280-P301 + P310 + P330-P302 + P352 + P310-P304 + P340 + P310-P391-P403 + P233

P261-P301 + P312 + P330-P305 + P351 + P338

P273

P201 - P273 - P280 - P302 + P352 - P304 + P340 + P310 - P305 + P351 + P338 + P310

P201-P261-P273-P280-P308 + P313-P391

P201-P273-P308 + P313-P501

P210-P305 + P351 + P338-P370 + P378-P403 + P235

P261-P264-P273-P280-P391-P403 + P233

P280 - P301 + P312 + P330 - P302 + P352 + P312 - P304 + P340 + P312 - P314

P210-P260-P280-P305 + P351 + P338-P370 + P378-P403 + P235

P262 - P273 - P280 - P301 + P310 + P330 - P302 + P352 + P310 - P304 + P340 + P310

Packaging

AcroSeal Glass Bottle

Amber Soda Lime Glass

Glass Bottle

Percent Purity

>=99.5% (GC)

90%

95%

99%

>=94.0% (GC)

>=97.0% (GC)

>=98%

98%

99+%

>=95.0% (GC)

>=98.0% (GC)

>=99%

94%

97%

97+%

99.85%

>=96.0% (GC)

>=99.0% (GC)

96%

99%

99+%

Physical Form

Clear Liquid at 20°C

Needles

Powder

Crystalline Powder

Crystal-Lump at 20°C

Crystalline Solid

Liquid

Pictogram

GHS02, GHS05

GHS05,GHS06,GHS08,GHS09

GHS06, GHS09

GHS07, GHS09

GHS02, GHS05, GHS07

GHS07, GHS08, GHS09

GHS09

GHS05, GHS06, GHS08, GHS09

GHS06,GHS09

GHS07

GHS07,GHS08

GHS08, GHS09

Pub Chem CID

12391

14257

16607

20414

624226

638079

7094

7269

9214

10821

11006

11210

1140

11597

13018

16968

10937607

11159354

11327

120463

11605

26058

13568

297

18936

356

7044

5364448

74210

5364394

78006

638066

8217

8222

6556

8900

9253

70004

98044726

7247

7055

77667

7947

7962

8141

8182

Quantity

1mL

5mL

Quantity

4 x 1L

50mL

25g

100mL

2500mL

250mL

500mL

2.5L

25mL

R-CODES

20/22-36/38

26/27/28-38-41-43-44-50/53-68

36-50/53

51/53

Refractive Index

1.3750 to 1.3780

1.4100 to 1.412

1.4680 to 1.4710

1.4830 to 1.485

1.4920 to 1.4940

1.4980 to 1.5000

1.548

1.3530 to 1.3550

1.398

1.4050 to 1.4070

1.4435 to 1.4455

1.3965 to 1.3985

1.4210 to 1.4230

1.422

1.4330 to 1.4350

1.4740 to 1.4760

Residue After Evaporation

0.001% max.

0.05% max.

Residueafter Evaporation

0.01 % max.

10ppm max.

RIDADR

UN 2729 6.1 / PGIII

NONH for all modes of transport

UN 3077 9 / PGIII

UN 2924 8(3) / PGII

RTECS Number

DD6475000

JR2125000

RA6115000

RG8400000

XS5250000

XT2570000

YQ1525000

S-Codes

26-36

36/37-60-61

53-45-60-61

Shelf Life

Limited shelf life, Expiry date on the label

Signal Word

Warning

Danger

SMILES

C#CC1=CC=CC=C1

C=CCCCC=C

C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=CC=CC=C3

C1CC=CC=C1

C1CCC(CC1)C2CCCCC2

C1CCCC1

CC(C)(C)C=C

CC1=CC2=CC=CC=C2C(=C1)C

CCCCCC=CC

CC1=CC=CC=C1

CCCCCCCCCCCCCCCC

C1CCC2CCCCC2C1

CCCCCCCCCCCC

C1CC2C3CCC(C3)C2C1

CC1=CC(=CC(=C1)C)C

CCC(C)C

CCCCCCCC

CCCCCCCCCCCCCCCCC=C

Quality

LiChropur ™

Solubility Information

Solubility in water: 0.0007g/L (20°C). Other solubilities: soluble in alcohol and acetone, freely miscible with ether, benzene, petroleum, ether and gasoline

Solubility in water: insoluble. Other solubilities: soluble in alcohol, acetone and ether

Solubility in water: insoluble. Other solubilities: soluble in hydrocarbons, oils and ether, slightly soluble in alcohol

Insoluble in water.

Miscible with ethyl ether,ethanol,acetone,benzene,petroleum ether and gasoline; Slightly Miscible with alcohol; Immiscible with water.

Solubility in water: insoluble. Other solubilities: soluble in acetone,benzene,alcohol,ether and,most hydrocarbon solvents

Solubility in water: insoluble. Other solubilities: soluble in alcohol, acetone, ether, petroleum and, coal-tar solvents

Solubility in water: slightly soluble (6mg/l at 20°C). Other solubilities: very soluble in acetone,benzene,ether and,ethanol

Miscible with ethyl alcohol,ethyl ether,acetone,chloroform and carbon tetrachloride. Immiscible with water.

Solubility in water: insoluble. Other solubilities: soluble in alcohol,acetone and ether

Specific Gravity

0.753

0.86

0.62

0.708

0.89

0.773

0.75

0.789

0.88

Recommended Storage

Ambient temperatures

Sensitivity

Light sensitive

Storage

2-8C

Synonym

iso-pentane

unii-t86pb90rnu

TSCA

Yes

UN Number

UN3295

3295

UN1262

Viscosity

3.6 mm2/s (40°C)

3 mPa.s (20°C)

3.032 mPa.s (25°C)

<7 mm2/s (40°C)

0.44 mPa.s (20°C)

Vapor Pressure

1mbar at 48°C

990mbar at 20°C

Water

0.1% max.

WGK

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