Basic information
- CAS
113674-51-4- Standard SMILES
O=Cc1ccccc1C(=O)OCc1ccccc1- InChIKey
OEWWFQYTNGODQM-UHFFFAOYSA-N- Molecular formula
- C15H12O3
- Average molar mass
- 240.25 g/mol
- Monoisotopic mass
- 240.07864424
Names & identifiers
- Preferred name
- Benzyl 2-formylbenzoate
- IUPAC
- benzyl 2-formylbenzoate
Names & synonyms
benzyl 2-formylbenzoate113674-51-4DTXSID90289049RefChem:328429DTXCID90240195Benzoic acid, 2-formyl-, phenylmethyl ester2-CarbobenzoxybenzaldehydeNSC58683SCHEMBL381019SCHEMBL1066455OEWWFQYTNGODQM-UHFFFAOYSA-NNSC-58683
Database identifiers
- CAS
113674-51-4- PubChem CID
- 246096
- DTXSID
DTXSID90289049
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 281
Related reactions
3 records
Compound notes
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