Methyl 2,3-dichloro-3-phenylpropanoate
Basic information
- CAS
35115-84-5- Standard SMILES
COC(=O)C(Cl)C(Cl)c1ccccc1- InChIKey
YOWWUZLQXXBDBP-UHFFFAOYSA-N- Molecular formula
- C10H10Cl2O2
- Average molar mass
- 233.09 g/mol
- Monoisotopic mass
- 232.0057849
Names & identifiers
- Preferred name
- Methyl 2,3-dichloro-3-phenylpropanoate
- IUPAC
- methyl 2,3-dichloro-3-phenylpropanoate
Names & synonyms
methyl 2,3-dichloro-3-phenylpropanoate35115-84-5DTXSID70305074RefChem:353599DTXCID80256205NSC168956SCHEMBL8925930NSC-168956
Database identifiers
- CAS
35115-84-5- PubChem CID
- 297697
- DTXSID
DTXSID70305074- Nikkaji
- J1.150.386A
Properties
Computed structural properties
- XLogP
- 2.9
- 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
- 191
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Compound notes
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