1,4:5,8-Dimethanonaphthalene-9,10-dione, decahydro-, (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)-(+-)-
Basic information
- CAS
131213-98-4- Standard SMILES
O=C1C2CCC1C1C3CCC(C3=O)C21- InChIKey
JZWOVBRVOSPPFJ-UHFFFAOYSA-N- Molecular formula
- C12H14O2
- Average molar mass
- 190.24 g/mol
- Monoisotopic mass
- 190.09937969
Names & identifiers
- Preferred name
- 1,4:5,8-Dimethanonaphthalene-9,10-dione, decahydro-, (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)-(+-)-
- IUPAC
- tetracyclo[6.2.1.13,6.02,7]dodecane-11,12-dione
Names & synonyms
131213-98-41,4:5,8-Dimethanonaphthalene-9,10-dione, decahydro-, (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)-(+-)-DTXSID40927126Decahydro-1,4:5,8-dimethanonaphthalene-9,10-dione1,4:5,8-Dimethanonaphthalene-9,10-dione, decahydro-, (1.alpha.,4.alpha.,4a.alpha.,5.alpha.,8.alpha.,8a.alpha)-(.+/-.)-
Database identifiers
- CAS
131213-98-4- PubChem CID
- 145606
- DTXSID
DTXSID40927126
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 284
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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