2,6-Bis(4-chlorophenyl)-3,5-dimethyloxan-4-one
Basic information
- CAS
67405-31-6- Standard SMILES
CC1C(=O)C(C)C(c2ccc(Cl)cc2)OC1c1ccc(Cl)cc1- InChIKey
WXCCAIAFARANBU-UHFFFAOYSA-N- Molecular formula
- C19H18Cl2O2
- Average molar mass
- 349.2 g/mol
- Monoisotopic mass
- 348.0683852
Names & identifiers
- Preferred name
- 2,6-Bis(4-chlorophenyl)-3,5-dimethyloxan-4-one
- IUPAC
- 2,6-bis(4-chlorophenyl)-3,5-dimethyloxan-4-one
Names & synonyms
67405-31-62,6-bis(4-chlorophenyl)-3,5-dimethyloxan-4-oneNSC319690DTXSID40317664NSC-319690
Database identifiers
- CAS
67405-31-6- PubChem CID
- 330609
- DTXSID
DTXSID40317664
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 376
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…