isobutyronitrile (CHEBI:28638)

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ChEBI Name	isobutyronitrile

ChEBI ID	CHEBI:28638

Definition	An aliphatic nitrile that is acetonitrile in which two of the hydrogens have been replaced by methyl groups.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:5991, CHEBI:24882

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Formula

C4H7N

Net Charge

Average Mass

69.105

Monoisotopic Mass

69.05785

InChI

InChI=1S/C4H7N/c1-4(2)3-5/h4H,1-2H3

InChIKey

LRDFRRGEGBBSRN-UHFFFAOYSA-N

SMILES

C(C#N)(C)C

Roles Classification
Chemical Role(s):	polar aprotic solvent A solvent with a comparatively high relative permittivity (or dielectric constant), greater than ca. 15, and a sizable permanent dipole moment, that cannot donate suitably labile hydrogen atoms to form strong hydrogen bonds.

Application(s):	polar aprotic solvent A solvent with a comparatively high relative permittivity (or dielectric constant), greater than ca. 15, and a sizable permanent dipole moment, that cannot donate suitably labile hydrogen atoms to form strong hydrogen bonds.

ChEBI Ontology
Outgoing	isobutyronitrile (CHEBI:28638) has role polar aprotic solvent (CHEBI:48358) isobutyronitrile (CHEBI:28638) is a aliphatic nitrile (CHEBI:80291) isobutyronitrile (CHEBI:28638) is a volatile organic compound (CHEBI:134179)

IUPAC Name

2-methylpropanenitrile

Last Modified

06 March 2017