Structure via PubChem · Public domain (PubChem)
phenylacetonitrile
Sign in to saveAlso known as benzyl nitrile, 2-phenylacetonitrile, (cyanomethyl)benzene, alpha-cyanotoluene, benzeneacetonitrile, benzyl cyanide, alpha-tolunitrile
chemical compound
Chemical data
- Formula
- C8H7N
- Molecular weight
- 117.15 g/mol
- IUPAC name
- 2-phenylacetonitrile
- SMILES
- C1=CC=C(C=C1)CC#N
- InChIKey
- SUSQOBVLVYHIEX-UHFFFAOYSA-N
- XLogP
- 1.6
- Polar surface area
- 23.8 Ų
- H-bond donors
- 0
- H-bond acceptors
- 1
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Molecule type
- Small molecule
via ChEMBL · EBI
Wikidata facts
- Subclass of
- chemical compound
- Has part
- hydrogen
- Mass
- 117.058
Show 5 more facts
- chemical formula
- C₈H₇N
- canonical SMILES
- C1=CC=C(C=C1)CC#N
- found in taxon
- Prunus padus
- melting point
- -24.0
- Commons category
- Benzyl cyanide
Sources (2)
via Wikidata · CC0