Basic information
- Standard SMILES
COC(=O)C(Oc1ccc(CBr)cc1Cl)c1ccccc1- InChIKey
HDHURFNSMYQBFY-UHFFFAOYSA-N- Molecular formula
- C16H14BrClO3
- Average molar mass
- 369.6 g/mol
Names & identifiers
- Preferred name
- Methyl 2-(2-chloro-4-bromomethylphenoxy)-2-phenylacetate
- IUPAC
- methyl 2-[4-(bromomethyl)-2-chlorophenoxy]-2-phenylacetate
Names & synonyms
SCHEMBL9051461HDHURFNSMYQBFY-UHFFFAOYSA-Nmethyl 2-(2-chloro-4-bromomethylphenoxy)-2-phenylacetate
Database identifiers
- PubChem CID
- 19385604
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 333
Related reactions
6 records
Compound notes
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