Ethyl 3-chloro-4-[(2-chlorobenzyl)oxy]-5-ethoxybenzoate
Basic information
- CAS
1706463-42-4- Standard SMILES
CCOC(=O)c1cc(Cl)c(OCc2ccccc2Cl)c(OCC)c1- InChIKey
PBRXXFRNMXAQJN-UHFFFAOYSA-N- Molecular formula
- C18H18Cl2O4
- Average molar mass
- 369.2 g/mol
- Monoisotopic mass
- 368.0582144
Names & identifiers
- Preferred name
- Ethyl 3-chloro-4-[(2-chlorobenzyl)oxy]-5-ethoxybenzoate
- IUPAC
- ethyl 3-chloro-4-[(2-chlorophenyl)methoxy]-5-ethoxybenzoate
Names & synonyms
DTXSID701146854AKOS025131725ethyl 3-chloro-4-[(2-chlorobenzyl)oxy]-5-ethoxybenzoateETHYL 3-CHLORO-4-[(2-CHLOROPHENYL)METHOXY]-5-ETHOXYBENZOATEBenzoic acid, 3-chloro-4-[(2-chlorophenyl)methoxy]-5-ethoxy-, ethyl ester1706463-42-4
Database identifiers
- CAS
1706463-42-4- PubChem CID
- 91682243
- DTXSID
DTXSID701146854
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 393
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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