2-(2-Chlorobenzyl)-6-methylphenyl 4-chlorobenzoate
Basic information
- CAS
6279-40-9- Standard SMILES
Cc1cccc(Cc2ccccc2Cl)c1OC(=O)c1ccc(Cl)cc1- InChIKey
GLQNRGAFJZFBLW-UHFFFAOYSA-N- Molecular formula
- C21H16Cl2O2
- Average molar mass
- 371.3 g/mol
- Monoisotopic mass
- 370.0527351
Names & identifiers
- Preferred name
- 2-(2-Chlorobenzyl)-6-methylphenyl 4-chlorobenzoate
- IUPAC
- [2-[(2-chlorophenyl)methyl]-6-methylphenyl] 4-chlorobenzoate
Names & synonyms
6279-40-9NSC113162-(2-chlorobenzyl)-6-methylphenyl 4-chlorobenzoateDTXSID50279123NSC-113162-[(2-CHLOROPHENYL)METHYL]-6-METHYLPHENYL 4-CHLOROBENZOATE
Database identifiers
- CAS
6279-40-9- PubChem CID
- 223577
- DTXSID
DTXSID50279123
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 434
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…