Basic information
- Standard SMILES
COC(=O)C(CC1CCC(OC)C1)c1ccc(Cl)c(Cl)c1- InChIKey
CPRNKFSLTVOMHN-UHFFFAOYSA-N- Molecular formula
- C16H20Cl2O3
- Average molar mass
- 331.2 g/mol
Names & identifiers
- Preferred name
- 2-(3,4-Dichloro-phenyl)-3-(3-methoxy-cyclopentyl)-propionic acid methyl ester
- IUPAC
- methyl 2-(3,4-dichlorophenyl)-3-(3-methoxycyclopentyl)propanoate
Names & synonyms
SCHEMBL2642365CPRNKFSLTVOMHN-UHFFFAOYSA-N2-(3,4-dichloro-phenyl)-3-(3-methoxy-cyclopentyl)-propionic acid methyl ester
Database identifiers
- PubChem CID
- 67482136
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 350
Related reactions
6 records
Compound notes
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