Basic information
- CAS
4599-94-4- Standard SMILES
O=C1c2cc3ccccc3cc2-c2ccc3ccccc3c21- InChIKey
TVSSQUFHTRMRMP-UHFFFAOYSA-N- Molecular formula
- C21H12O
- Average molar mass
- 280.3 g/mol
- Monoisotopic mass
- 280.088815
Names & identifiers
- Preferred name
- 13H-Dibenzo(a,h)fluoren-13-one
- IUPAC
- pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-12-one
Names & synonyms
13H-DIBENZO(A,H)FLUOREN-13-ONE4599-94-4DTXSID8019667713H-Dibenzo[a,h]fluoren-13-oneRefChem:236543DTXCID20119168SCHEMBL16144670
Database identifiers
- CAS
4599-94-4- PubChem CID
- 20730
- DTXSID
DTXSID80196677- Nikkaji
- J1.554.320E
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 455
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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