Basic information
- Standard SMILES
COC(=O)c1ccc(OC)c(OCCc2ccc(Cl)cc2Cl)c1- InChIKey
AGSUGOJZYBWBRS-UHFFFAOYSA-N- Molecular formula
- C17H16Cl2O4
- Average molar mass
- 355.2 g/mol
Names & identifiers
- Preferred name
- 3-[2-(2,4-Dichlorophenyl)-ethoxy]-4-methoxy-benzoic Acid Methyl Ester
- IUPAC
- methyl 3-[2-(2,4-dichlorophenyl)ethoxy]-4-methoxybenzoate
Names & synonyms
SCHEMBL5088106AGSUGOJZYBWBRS-UHFFFAOYSA-N3-[2-(2,4-Dichlorophenyl)-ethoxy]-4-methoxy-benzoic Acid Methyl Ester
Database identifiers
- PubChem CID
- 69306341
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 380
Related reactions
6 records
Compound notes
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