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Basic information
- Standard SMILES
N#CC=Cc1ccc(OCc2ccccc2)cc1- InChIKey
OSGFJSAOKKUNFI-UHFFFAOYSA-N- Molecular formula
- C16H13NO
- Average molar mass
- 235.28 g/mol
- Monoisotopic mass
- 235.09971404
Names & identifiers
- Preferred name
- 3-(4-Benzyloxyphenyl)acrylonitrile
- IUPAC
- 3-(4-phenylmethoxyphenyl)prop-2-enenitrile
Names & synonyms
SCHEMBL5148666OSGFJSAOKKUNFI-UHFFFAOYSA-N3-(4-benzyloxyphenyl)acrylonitrile3-(4-benzyloxyphenyl)-acrylonitrileAKOS017269581
Database identifiers
- PubChem CID
- 3955698
Properties
Computed structural propertiesFilling in
- XLogP
- 3.9
- Topological polar surface area
- 33 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 300
Related reactions
4 records
Compound notes
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