Basic information
- CAS
88952-31-2- Standard SMILES
COc1ccc(C(=O)Oc2c(Cl)cc(Cl)cc2C(C)=O)cc1- InChIKey
JJXKSMKIZATCBK-UHFFFAOYSA-N- Molecular formula
- C16H12Cl2O4
- Average molar mass
- 339.2 g/mol
- Monoisotopic mass
- 338.0112642
Names & identifiers
- Preferred name
- 2-Acetyl-4,6-dichlorophenyl 4-methoxybenzoate
- IUPAC
- (2-acetyl-4,6-dichlorophenyl) 4-methoxybenzoate
Names & synonyms
88952-31-22-Acetyl-4,6-dichlorophenyl 4-methoxybenzoateDTXSID20526035
Database identifiers
- CAS
88952-31-2- PubChem CID
- 13190834
- DTXSID
DTXSID20526035
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 407
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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