Basic information
- CAS
30773-71-8- Standard SMILES
CC(=O)c1ccc(C(C)=O)cc1.CC(=O)c1cccc(C(C)=O)c1.CC(=O)c1ccccc1C(C)=O- InChIKey
HMAOFTSVJZKYHA-UHFFFAOYSA-N- Molecular formula
- C30H30O6
- Average molar mass
- 486.6 g/mol
- Monoisotopic mass
- 486.20423867
Names & identifiers
- Preferred name
- 1,1'-(Phenylene)bisethanone
- IUPAC
- 1-(2-acetylphenyl)ethanone;1-(3-acetylphenyl)ethanone;1-(4-acetylphenyl)ethanone
Names & synonyms
1,1'-(PHENYLENE)BISETHANONE30773-71-8DTXSID80184791
Database identifiers
- CAS
30773-71-8- PubChem CID
- 35458
- DTXSID
DTXSID80184791
Properties
Computed structural properties
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 516
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…