ChemicalBook--->CAS DataBase List--->542-54-1

542-54-1

542-54-1 Structure

542-54-1 Structure
IdentificationBack Directory
[Name]

ISOCAPRONITRILE
[CAS]

542-54-1
[Synonyms]

Isoamylkyanid
ISOAMYL CYANIDE
ISOCAPRONITRILE
isohexanonitrile
isopentylcyanide
Isohexanenitrile
Isopentyl cyanide
isobutylacetonitrile
4-Methylvaleronitril
4-methyl-valeronitril
4-METHYLVALERONITRILE
4-methyl-pentanenitril
4-Methylpentanonitrile
4-Methyl pentanenitrile
Pentanenitrile,4-methyl-
Valeronitrile, 4-methyl-
4-METHYL-N-VALERONITRILE
Isoamyl Cyanide 4-Methylvaleronitrile
[EINECS(EC#)]

208-817-6
[Molecular Formula]

C6H11N
[MDL Number]

MFCD00001967
[MOL File]

542-54-1.mol
[Molecular Weight]

97.16
Chemical PropertiesBack Directory
[Melting point ]

-51°
[Boiling point ]

155 °C
[density ]

0,8 g/cm3
[refractive index ]

1.4050-1.4070
[Fp ]

45°C
[Water Solubility ]

Insoluble in water
[form ]

clear liquid
[color ]

Colorless to Almost colorless
[Merck ]

14,5117
[Dielectric constant]

15.7(20℃)
[InChI]

InChI=1S/C6H11N/c1-6(2)4-3-5-7/h6H,3-4H2,1-2H3
[InChIKey]

DUJMVKJJUANUMQ-UHFFFAOYSA-N
[SMILES]

C(#N)CCC(C)C
[CAS DataBase Reference]

542-54-1
[EPA Substance Registry System]

Pentanenitrile, 4-methyl- (542-54-1)
Safety DataBack Directory
[Risk Statements ]

10-23/24/25
[Safety Statements ]

16-26-36/37/39
[RIDADR ]

1992
[RTECS ]

YV8588000
[TSCA ]

TSCA listed
[HS Code ]

2926.90.5050
[HazardClass ]

3.2
[PackingGroup ]

III
Spectrum DetailBack Directory
[Spectrum Detail]

ISOCAPRONITRILE(542-54-1)MS
ISOCAPRONITRILE(542-54-1)1HNMR
ISOCAPRONITRILE(542-54-1)13CNMR
ISOCAPRONITRILE(542-54-1)IR1
ISOCAPRONITRILE(542-54-1)IR2
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