Basic information
- CAS
33982-94-4- Standard SMILES
CC1=CCC2C(=O)C3CC(C)=CCC3C(=O)C2C1- InChIKey
KPSCBYIEVIABQP-UHFFFAOYSA-N- Molecular formula
- C16H20O2
- Average molar mass
- 244.33 g/mol
- Monoisotopic mass
- 244.14632988
Names & identifiers
- Preferred name
- 2,6-Dimethyl-1,4,4a,5,8,8a,9a,10a-octahydroanthracene-9,10-dione
- IUPAC
- 2,6-dimethyl-1,4,4a,5,8,8a,9a,10a-octahydroanthracene-9,10-dione
- English name
- 2,6-dimethyl-1,4,4a,5,8,8a,9a,10a-octahydroanthracene-9,10-dione
- Molecular formula
- C16H20O2
- Molecular weight
- 0
Names & synonyms
2,6-dimethyl-1,4,4a,5,8,8a,9a,10a-octahydroanthracene-9,10-dione33982-94-4NSC80854SCHEMBL10337971DTXSID80955564NSC-80854
Database identifiers
- CAS
33982-94-4- PubChem CID
- 255396
- DTXSID
DTXSID80955564- Nikkaji
- J1.030.050I
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 425
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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