1-(4-Bromophenyl)-2-(2-chlorophenoxy)ethanone
Basic information
- CAS
111946-85-1- Standard SMILES
O=C(COc1ccccc1Cl)c1ccc(Br)cc1- InChIKey
QPPKQOYYKKVJJB-UHFFFAOYSA-N- Molecular formula
- C14H10BrClO2
- Average molar mass
- 325.58 g/mol
- Monoisotopic mass
- 323.95527
Names & identifiers
- Preferred name
- 1-(4-Bromophenyl)-2-(2-chlorophenoxy)ethanone
- IUPAC
- 1-(4-bromophenyl)-2-(2-chlorophenoxy)ethanone
Names & synonyms
1-(4-bromophenyl)-2-(2-chlorophenoxy)ethanone111946-85-1RefChem:74424Cambridge id 72245511-(4-bromophenyl)-2-(2-chlorophenoxy)ethan-1-oneDTXSID801252012STK275259AKOS003290937NCGC00330268-01AB00309964-03
Database identifiers
- CAS
111946-85-1- PubChem CID
- 896198
- DTXSID
DTXSID801252012
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 277
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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