Basic information
- CAS
41198-40-7- Standard SMILES
O=C(CCOc1ccc(Cl)cc1)c1ccccc1- InChIKey
QENWTZPJTPOTIQ-UHFFFAOYSA-N- Molecular formula
- C15H13ClO2
- Average molar mass
- 260.71 g/mol
- Monoisotopic mass
- 260.0604073
Names & identifiers
- Preferred name
- 3-(4-Chlorophenoxy)-1-phenylpropan-1-one
- IUPAC
- 3-(4-chlorophenoxy)-1-phenylpropan-1-one
Names & synonyms
3-(4-Chlorophenoxy)-1-phenylpropan-1-one41198-40-7DTXSID80785641
Database identifiers
- CAS
41198-40-7- PubChem CID
- 71361997
- DTXSID
DTXSID80785641
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 253
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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