2-methylpentane (Q209445)

2-METHYLPENTANE (English)

9 October 2016

chemical formula

C₆H₁₄

1 reference

2-METHYLPENTANE (English)

18 November 2016

canonical SMILES

CCCC(C)C

1 reference

2-METHYLPENTANE (English)

18 November 2016

ionization energy

10.12 electronvolt

1 reference

Basic laboratory and industrial chemicals: A CRC quick reference handbook

melting point

−154.0 degree Celsius

1 reference

Jean-Claude Bradley Open Melting Point Dataset

−153.7 degree Celsius

1 reference

Basic laboratory and industrial chemicals: A CRC quick reference handbook

boiling point

333.43 kelvin

1 reference

Boiling Point Relationships among Aliphatic Hydrocarbons.

60.26 degree Celsius

under pressure

101.325 kilopascal

1 reference

Basic laboratory and industrial chemicals: A CRC quick reference handbook

safety classification and labelling

NFPA 704: Standard System for the Identification of the Hazards of Materials for Emergency Response

no value

1 reference

imported from Wikimedia project

English Wikipedia

NIOSH Pocket Guide ID

0323

0 references

found in taxon

Vitis rotundifolia

1 reference

Identification of the Volatile Constituents from Scuppernong Berries (Vitis rotundifolia)

tomato

1 reference

Effect of autochthonous lactic acid bacteria starters on health-promoting and sensory properties of tomato juices

Commons category

Isohexane

0 references

Identifiers

InChI

InChI=1S/C6H14/c1-4-5-6(2)3/h6H,4-5H2,1-3H3

1 reference

2-METHYLPENTANE (English)

18 November 2016

2 references

2-METHYLPENTANE (English)

18 November 2016

ChEBI release 2020-09-01

CAS Registry Number

107-83-5

2 references

Global Substance Registration System

2-methylpentane (English)

18 November 2016

https://commonchemistry.cas.org/detail?cas_rn=107-83-5

9 April 2021

73513-42-5

reason for deprecated rank

does not exactly match

0 references

1 reference

isohexane (English)

18 November 2016

2 references

2-METHYLPENTANE (English)

18 November 2016

ChEBI ID

88374

mapping relation type

2 references

CHEMBL30909 (English)

18 November 2016

International Chemical Identifier

InChI

InChI=1S/C6H14/c1-4-5-6(2)3/h6H,4-5H2,1-3H3

1 reference

MSBNK-Fac_Eng_Univ_Tokyo-JP001850

CHEMBL30909 (English)

18 November 2016

1 reference

MassBank accession ID

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP012132

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP008569

0 references

SPLASH

splash10-0006-9000000000-b52721b6aaea54e0c25b

0 references

splash10-0079-9000000000-07e07135ee1b1d90b27d

0 references

splash10-0006-9000000000-189ad38b0543fed83cae

0 references

NMRShiftDB structure ID

10016356

1 reference

https://www.wikidata.org/wiki/Wikidata:Property_proposal/CAMEO_Chemicals_ID

0 references

1 reference

UN number

1208

1 reference

imported from Wikimedia project

0 references

1 reference

Hazardous Substances Data Bank

28 October 2019

2-METHYLPENTANE (English)

10 May 2021

2 references

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

0 references

0 references

1 reference

Global Substance Registration System

2-methylpentane (English)

ECHA Substance Infocard ID

18 November 2016

100.003.204

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.003.204

27 December 2018

OSHA Occupational Chemical Database ID

2-methylpentane (English)

quotation

CAS no.: 107-83-5 (English)

0 references

1 reference

0 references

Human Metabolome Database ID

HMDB0061884

2 references

based on heuristic

inferred from InChIKey

KNApSAcK ID

C00059084

2 references

based on heuristic

inferred from InChIKey

2 references

Global Substance Registration System

2-methylpentane (English)

18 November 2016