Naphth[2,3-a]azulene-5,12-dione
Basic information
- CAS
76319-75-0- Standard SMILES
O=C1c2ccccc2C(=O)c2c1cc1cccccc2-1- InChIKey
HUHSITKSALDDRD-UHFFFAOYSA-N- Molecular formula
- C18H10O2
- Average molar mass
- 258.3 g/mol
- Monoisotopic mass
- 258.06807956
Names & identifiers
- Preferred name
- Naphth[2,3-a]azulene-5,12-dione
- IUPAC
- tetracyclo[8.8.0.02,8.012,17]octadeca-1,3,5,7,9,12,14,16-octaene-11,18-dione
Names & synonyms
76319-75-0Naphth[2,3-a]azulene-5,12-dioneNSC349396DTXSID00319689Naphtho[2,3-a]azulene-5,12-dioneNSC-349396
Database identifiers
- CAS
76319-75-0- PubChem CID
- 336176
- DTXSID
DTXSID00319689
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 427
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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