Basic information
- Standard SMILES
CCOC(=O)Cc1cc(Cl)cc(Oc2ccc(Br)cc2CBr)c1- InChIKey
HGGSQEMERAWAII-UHFFFAOYSA-N- Molecular formula
- C17H15Br2ClO3
- Average molar mass
- 462.6 g/mol
Names & identifiers
- Preferred name
- [3-(4-Bromo-2-bromomethyl-phenoxy)-5-chloro-phenyl]-acetic acid ethyl ester
- IUPAC
- ethyl 2-[3-[4-bromo-2-(bromomethyl)phenoxy]-5-chlorophenyl]acetate
Names & synonyms
SCHEMBL1643092HGGSQEMERAWAII-UHFFFAOYSA-N[3-(4-bromo-2-bromomethyl-phenoxy)-5-chloro-phenyl]-acetic acid ethyl ester
Database identifiers
- PubChem CID
- 58237642
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 383
Related reactions
5 records
Compound notes
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