(3,4-Dichlorophenyl)methyl propanoate
Basic information
- CAS
85263-01-0- Standard SMILES
CCC(=O)OCc1ccc(Cl)c(Cl)c1- InChIKey
PUVVYQAJJXXUAB-UHFFFAOYSA-N- Molecular formula
- C10H10Cl2O2
- Average molar mass
- 233.09 g/mol
- Monoisotopic mass
- 232.0057849
Names & identifiers
- Preferred name
- (3,4-Dichlorophenyl)methyl propanoate
- IUPAC
- (3,4-dichlorophenyl)methyl propanoate
Names & synonyms
85263-01-0(3,4-dichlorophenyl)methyl propanoateNSC404634SCHEMBL27846776DTXSID50323675NSC-404634
Database identifiers
- CAS
85263-01-0- PubChem CID
- 346403
- DTXSID
DTXSID50323675
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 197
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Compound notes
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