4',4'''-Bipropiophenone
Basic information
- CAS
4392-77-2- Standard SMILES
CCC(=O)c1ccc(-c2ccc(C(=O)CC)cc2)cc1- InChIKey
YJIMYKDSJGRKAL-UHFFFAOYSA-N- Molecular formula
- C18H18O2
- Average molar mass
- 266.3 g/mol
- Monoisotopic mass
- 266.13067981
Names & identifiers
- Preferred name
- 4',4'''-Bipropiophenone
- IUPAC
- 1-[4-(4-propanoylphenyl)phenyl]propan-1-one
Names & synonyms
4392-77-2NSC4021724',4'''-BipropiophenoneSCHEMBL10389933DTXSID80322853NSC-4021721-(4'-Propionyl-biphenyl-4-yl)-propan-1-one1,1'-([1,1'-Biphenyl]-4,4'-diyl)di(propan-1-one)
Database identifiers
- CAS
4392-77-2- PubChem CID
- 344982
- DTXSID
DTXSID80322853- Nikkaji
- J2.467.651J
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 297
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical structure
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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