Basic information
- CAS
112575-91-4- Standard SMILES
O=C1C=C2c3cc4ccccc4cc3-c3cccc(c32)C1=O- InChIKey
VOEVTZTWLPIXSI-UHFFFAOYSA-N- Molecular formula
- C20H10O2
- Average molar mass
- 282.3 g/mol
- Monoisotopic mass
- 282.06807956
Names & identifiers
- Preferred name
- Benzo(k)fluoranthene-2,3-dione
- IUPAC
- benzo[k]fluoranthene-4,5-dione
Names & synonyms
Benzo(k)fluoranthene-2,3-dioneCCRIS 1510Benzo(k)fluoranthene-2,3-quinone112575-91-4ZQ3BFX98WSBenzo[k]fluoranthene-2,3-dioneUNII-ZQ3BFX98WSDTXSID50150105BENZO[K]FLUORANTHENE-2,3-QUINONERefChem:118252DTXCID2072596Q27894327
Database identifiers
- CAS
112575-91-4- PubChem CID
- 150573
- DTXSID
DTXSID50150105- UNII
- ZQ3BFX98WS
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 560
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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