α-Methyl-4-(2-methylpropyl)benzeneacetonitrile
CAS Registry Number®
58609-73-7
CAS Name
α-Methyl-4-(2-methylpropyl)benzeneacetonitrileMolecular Formula
C13H17NMolecular Mass
187.28Cite this Page
α-Methyl-4-(2-methylpropyl)benzeneacetonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=58609-73-7 (retrieved ) (CAS RN: 58609-73-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C13H17N/c1-10(2)8-12-4-6-13(7-5-12)11(3)9-14/h4-7,10-11H,8H2,1-3H3
InChIKey
InChIKey=PKQKHWNHCKNYSW-UHFFFAOYSA-N
SMILES
C(C(C)C)C1=CC=C(C(C#N)C)C=C1
Canonical SMILES
N#CC(C1=CC=C(C=C1)CC(C)C)C
Other Names for this Substance
- Benzeneacetonitrile, α-methyl-4-(2-methylpropyl)-
- α-Methyl-4-(2-methylpropyl)benzeneacetonitrile
- 2-(4-Isobutylphenyl)propionitrile
- 2-(4′-Isobutylphenyl)propionitrile
- 2-(4-Isobutylphenyl)propanenitrile
Deleted or Replaced CAS Registry Numbers
99148-34-2, 158268-53-2