Benzoic acid,3-(2-phenylethyl)-,methyl ester

HCID 53961900
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Basic information

Standard SMILES
COC(=O)c1cccc(CCc2ccccc2)c1
InChIKey
WFEXYPQDVOVOOW-UHFFFAOYSA-N
Molecular formula
C16H16O2
Average molar mass
240.3 g/mol

Names & identifiers

Preferred name
Benzoic acid,3-(2-phenylethyl)-,methyl ester
IUPAC
methyl 3-(2-phenylethyl)benzoate

Names & synonyms

BENZOIC ACID,3-(2-PHENYLETHYL)-,METHYL ESTER194605-54-4METHYL 3-(2-PHENYLETHYL)BENZOATE3-Phenethyl-benzoic acid methyl esterSCHEMBL1926802SCHEMBL8710710WFEXYPQDVOVOOW-UHFFFAOYSA-N

Database identifiers

PubChem CID
53961900

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
18

Related reactions

4 records
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Compound notes

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