2-(2-Chlorobenzyl)-4-methylphenyl 4-chlorobenzoate
Basic information
- CAS
6279-39-6- Standard SMILES
Cc1ccc(OC(=O)c2ccc(Cl)cc2)c(Cc2ccccc2Cl)c1- InChIKey
GVUDSPRVKMUSGD-UHFFFAOYSA-N- Molecular formula
- C21H16Cl2O2
- Average molar mass
- 371.3 g/mol
- Monoisotopic mass
- 370.0527351
Names & identifiers
- Preferred name
- 2-(2-Chlorobenzyl)-4-methylphenyl 4-chlorobenzoate
- IUPAC
- [2-[(2-chlorophenyl)methyl]-4-methylphenyl] 4-chlorobenzoate
Names & synonyms
2-(2-chlorobenzyl)-4-methylphenyl 4-chlorobenzoate6279-39-6NSC11314DTXSID30279121NSC-113142-[(2-CHLOROPHENYL)METHYL]-4-METHYLPHENYL 4-CHLOROBENZOATE
Database identifiers
- CAS
6279-39-6- PubChem CID
- 223575
- DTXSID
DTXSID30279121
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
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