ChemicalBook--->CAS DataBase List--->1678-92-8

1678-92-8

1678-92-8 Structure

1678-92-8 Structure
IdentificationMore
[Name]

PROPYLCYCLOHEXANE
[CAS]

1678-92-8
[Synonyms]

1-CYCLOHEXYLPROPANE
N-PROPYLCYCLOHEXANE
PROPYLCYCLOHEXANE
Cyclohexane, n-propyl-
cyclohexane,propyl-
[EINECS(EC#)]

216-836-6
[Molecular Formula]

C9H18
[MDL Number]

MFCD00013770
[Molecular Weight]

126.24
[MOL File]

1678-92-8.mol
Chemical PropertiesBack Directory
[Melting point ]

-95 °C
[Boiling point ]

155 °C (lit.)
[density ]

0.793 g/mL at 25 °C(lit.)
[vapor pressure ]

8.7 mm Hg ( 37.7 °C)
[refractive index ]

n20/D 1.436(lit.)
[Fp ]

95 °F
[storage temp. ]

Storage temp. 2-8°C
[form ]

clear liquid
[color ]

Colorless to Almost colorless
[Specific Heat Capacity]

Cp(liquid):242J/(g·K),at 25℃
[Henry's Law Constant]

9.6×10-6 mol/(m3Pa) at 25℃, Yaws (2003)
[InChI]

1S/C9H18/c1-2-6-9-7-4-3-5-8-9/h9H,2-8H2,1H3
[InChIKey]

DEDZSLCZHWTGOR-UHFFFAOYSA-N
[SMILES]

CCCC1CCCCC1
[LogP]

4.717 (est)
[CAS DataBase Reference]

1678-92-8(CAS DataBase Reference)
[EPA Substance Registry System]

Cyclohexane, propyl- (1678-92-8)
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)
GHS02
[Signal word ]

Warning
[Hazard statements ]

H304-H226
[Precautionary statements ]

P501-P240-P210-P233-P243-P241-P242-P280-P370+P378-P331-P303+P361+P353-P301+P310-P403+P235-P405
[Risk Statements ]

R10:Flammable.
[Safety Statements ]

S16:Keep away from sources of ignition-No smoking .
S29:Do not empty into drains .
S33:Take precautionary measures against static discharges .
[RIDADR ]

UN 3295 3/PG 3
[WGK Germany ]

3
[Autoignition Temperature]

478 °F
[HS Code ]

2902.19.0050
[HazardClass ]

3.2
[PackingGroup ]

III
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Flam. Liq. 3
Hazard InformationBack Directory
[Uses]

Propylcyclohexane is a component of the surrogate biokerosene model fuel. It has been used in the kinetic studies of kerosene Jet A-1 oxidation. It has also been used to assay kerosene/rapeseed oil methyl ester (RME) mixture (80/20, mol/mol; biokerosene).
[Synthesis Reference(s)]

Journal of the American Chemical Society, 73, p. 4152, 1951 DOI: 10.1021/ja01153a031
Spectrum DetailBack Directory
[Spectrum Detail]

PROPYLCYCLOHEXANE(1678-92-8)MS
PROPYLCYCLOHEXANE(1678-92-8)1HNMR
PROPYLCYCLOHEXANE(1678-92-8)13CNMR
PROPYLCYCLOHEXANE(1678-92-8)IR1
PROPYLCYCLOHEXANE(1678-92-8)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

1678-92-8(sigmaaldrich)
[TCI AMERICA]

Propylcyclohexane,>98.0%(GC)(1678-92-8)
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