Basic information
- Standard SMILES
O=C(CCc1ccccc1)OCc1ccccc1- InChIKey
IGUMLGLEYCGKBJ-UHFFFAOYSA-N- Molecular formula
- C16H16O2
- Average molar mass
- 240.3 g/mol
Names & identifiers
- Preferred name
- Benzyl 3-phenylpropanoate
- IUPAC
- benzyl 3-phenylpropanoate
Names & synonyms
Benzyl 3-phenylpropanoatebenzyl 3-phenylpropionateBenzyl hydrocinnamic acidbenzenepropanoic acid benzyl esterBenzyldihydrocinnamat3-phenyl-propionic acid benzyl esterBenzyl hydrocinnamateBenzyl 3-phenylpropanoate #SCHEMBL304176SCHEMBL4065633SCHEMBL9677845SCHEMBL11286166
Show more names
SCHEMBL112861673-Phenylpropionic acid, benzyl ester
Database identifiers
- PubChem CID
- 562789
- Nikkaji
- J599.367I
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 237
Related reactions
5 records
Compound notes
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