ChemicalBook--->CAS DataBase List--->31394-54-4

31394-54-4

31394-54-4 Structure

31394-54-4 Structure
IdentificationBack Directory
[Name]

ISOHEPTANE
[CAS]

31394-54-4
[Synonyms]

Isobepane
ISOHEPTANE
ISOHEPTANES
Isobepane(mixture of isomers)
isoheptanes(mixtureofisomericbranchedchainheptanes)
Isoheptane (mixture of isomeric branched chain heptanes)
[EINECS(EC#)]

250-610-8
[Molecular Formula]

C7H16
[MDL Number]

MFCD00197839
[MOL File]

31394-54-4.mol
[Molecular Weight]

100.2
Chemical PropertiesBack Directory
[Melting point ]

25.5 °C
[Boiling point ]

89.3-89.4 °C(Press: 748 Torr)
[density ]

0.6842 g/cm3(Temp: 15 °C)
[Fp ]

-11 °C
[Odor Threshold]

0.42ppm
[CAS DataBase Reference]

31394-54-4
[EPA Substance Registry System]

Isoheptane (31394-54-4)
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)Health Hazard (GHS08)Exclamation Mark (GHS07)Environment (GHS09)
GHS02,GHS08,GHS07,GHS09
[Signal word ]

Danger
[Hazard statements ]

H315-H336-H304-H225-H410
[Precautionary statements ]

P264-P280-P302+P352-P321-P332+P313-P362-P210-P233-P240-P241-P242-P243-P280-P303+P361+P353-P370+P378-P403+P235-P501-P273-P391-P501-P261-P271-P304+P340-P312-P403+P233-P405-P501
[TSCA ]

TSCA listed
[REACH Registrations]

Active
Raw materials And Preparation ProductsBack Directory
Hazard InformationBack Directory
[Uses]

Isoheptane is a hydrocarbon compound commonly used in chemical production and experimental research. It is used as a component of anti-explosive materials and as an extraction solvent for the extraction of corn oil from whole germ. In addition, it is used in statistical thermodynamic studies of the isomerisation reactions of n-heptane and isoheptane[1-3].
[References]

[1] NAGAI Y. Effect of Anti-knock Materials on the Limits of Inflammability of Ethyl Ether and Hydrocarbon[C]. 1900. DOI:10.2183/PJAB1912.3.664.
[2] LIONEL K. ARNOLD; William E R. Extraction of corn oil by three petroleum solvents[J]. Journal of the American Oil Chemists Society, 1956. DOI:10.1007/BF02630765.
[3] YU T, ZHENG J, TRUHLAR D G. Statistical thermodynamics of the isomerization reaction between n-heptane and isoheptane?[J]. Physical Chemistry Chemical Physics, 2011. DOI:10.1039/C1CP22578B.
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