Basic information
- Standard SMILES
COC(=O)C(C)c1cccc(Oc2ccccc2)c1- InChIKey
FUOQIQZCJJDBGD-UHFFFAOYSA-N- Molecular formula
- C16H16O3
- Average molar mass
- 256.3 g/mol
- Monoisotopic mass
- 256.10994437
Names & identifiers
- Preferred name
- Methyl 2-(3-phenoxyphenyl)propanoate
- IUPAC
- methyl 2-(3-phenoxyphenyl)propanoate
Names & synonyms
Methyl 2-(3-phenoxyphenyl)propanoate66202-87-7Fenoprofen Methyl Estermethyl 2-(3-phenoxyphenyl)propionateMethyl ester of FenoprofenFenoprofen methyl derivativeSCHEMBL5110018AT50514Methyl 2-(3-phenoxyphenyl)propanoate #methyl alpha-(m-phenoxyphenyl)propionatemethyl-2-(3-phenoxy-phenyl)-propionate82846-47-7
Show more names
DA-03805Benzeneacetic acid, .alpha.-methyl-3-phenoxy-, methyl ester, (.+/-.)-Fenoprofen Methyl Ester; alpha-Methyl-3-phenoxybenzeneacetic acid methyl ester; Methyl 2-(3-phenoxyphenyl)propionate
Database identifiers
- PubChem CID
- 529082
- Nikkaji
- J534.218J
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 284
Experimental & physicochemical properties
Kovats Retention Index1970；1885.3
Related reactions
11 records
Compound notes
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