Basic information
- CAS
2901-18-0- Standard SMILES
CCOC(=O)C(Cc1ccc(Cl)cc1)(Cc1ccc(Cl)cc1)c1ccccc1- InChIKey
TWDWIYUBFZPGSB-UHFFFAOYSA-N- Molecular formula
- C24H22Cl2O2
- Average molar mass
- 413.3 g/mol
- Monoisotopic mass
- 412.0996853
Names & identifiers
- Preferred name
- Ethyl 2-(4-chlorobenzyl)-3-(4-chlorophenyl)-2-phenylpropanoate
- IUPAC
- ethyl 3-(4-chlorophenyl)-2-[(4-chlorophenyl)methyl]-2-phenylpropanoate
Names & synonyms
2901-18-0ethyl 2-(4-chlorobenzyl)-3-(4-chlorophenyl)-2-phenylpropanoateNSC97474DTXSID40294628NSC-97474ethyl 3-(4-chlorophenyl)-2-[(4-chlorophenyl)methyl]-2-phenylpropanoate3-n-Propyl-2-pyrazolin-5-one, 98%
Database identifiers
- CAS
2901-18-0- PubChem CID
- 263133
- DTXSID
DTXSID40294628
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 449
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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