Basic information
- Standard SMILES
C=CC1CC1(C#N)C(=O)OCc1cccc(Oc2ccccc2)c1- InChIKey
GLTPOLDNOBCIJY-UHFFFAOYSA-N- Molecular formula
- C20H17NO3
- Average molar mass
- 319.4 g/mol
- Monoisotopic mass
- 319.1208434
Names & identifiers
- Preferred name
- (3-Phenoxy)benzyl 2-vinyl-1-cyanocyclopropane-1-carboxylate
- IUPAC
- (3-phenoxyphenyl)methyl 1-cyano-2-ethenylcyclopropane-1-carboxylate
Names & synonyms
SCHEMBL10984832GLTPOLDNOBCIJY-UHFFFAOYSA-N(3-phenoxy)benzyl 2-vinyl-1-cyanocyclopropane-1-carboxylate
Database identifiers
- PubChem CID
- 13558231
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 59.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 516
Related reactions
2 records
Compound notes
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