Basic information
- Standard SMILES
CCOC(=O)c1ccccc1-c1ccccc1-c1ccc(Cl)cc1OCc1ccccc1- InChIKey
ITILGTYNTIWTCF-UHFFFAOYSA-N- Molecular formula
- C28H23ClO3
- Average molar mass
- 442.9 g/mol
Names & identifiers
- Preferred name
- Ethyl 4''-chloro-2''-[(phenylmethyl)oxy]-1,1':2',1''-terphenyl-2-carboxylate
- IUPAC
- ethyl 2-[2-(4-chloro-2-phenylmethoxyphenyl)phenyl]benzoate
Names & synonyms
SCHEMBL5109217ITILGTYNTIWTCF-UHFFFAOYSA-NEthyl 4''-chloro-2''-[(phenylmethyl)oxy]-1,1':2',1''-terphenyl-2-carboxylate
Database identifiers
- PubChem CID
- 58730979
Properties
Computed structural properties
- XLogP
- 7.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 575
Related reactions
2 records
Compound notes
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