CAS Registry Number®
140-29-4
CAS Name
Phenylacetonitrile
Molecular Formula
C8H7N
Molecular Mass
117.15
Compound Properties
-
Boiling Point (1)
233.5 °C
-
Melting Point (1)
-23.8 °C
-
Density (1)
1.0214 g/cm3 @ Temp: 15 °C
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
InChI
InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2
InChIKey
InChIKey=SUSQOBVLVYHIEX-UHFFFAOYSA-N
SMILES
C(C#N)C1=CC=CC=C1
Canonical SMILES
N#CCC=1C=CC=CC1
Other Names for this Substance
- Benzeneacetonitrile
- Acetonitrile, phenyl-
- Benzyl cyanide
- Benzyl nitrile
- ω-Cyanotoluene
- Phenylacetonitrile
- α-Tolunitrile
- α-Cyanotoluene
- 2-Phenylacetonitrile
- (Cyanomethyl)benzene
- Phenacetonitrile
- α-Phenylacetonitrile
- 2-Phenylethanenitrile
- NSC 118418
- NSC 3407
- Benzeneethanenitrile
