(10R,11R)-10,11-Dihydro-10,11-dihydroxy-11-methylbenz(a)anthracene
Basic information
- CAS
82735-50-0- Standard SMILES
C[C@@]1(O)c2cc3c(ccc4ccccc43)cc2C=C[C@H]1O- InChIKey
LUZRIDJKIKIKNX-RTBURBONSA-N- Molecular formula
- C19H16O2
- Average molar mass
- 276.3 g/mol
- Monoisotopic mass
- 276.11502975
Names & identifiers
- Preferred name
- (10R,11R)-10,11-Dihydro-10,11-dihydroxy-11-methylbenz(a)anthracene
- IUPAC
- (10R,11R)-11-methyl-10H-benzo[a]anthracene-10,11-diol
Names & synonyms
(10R,11R)-10,11-Dihydro-10,11-dihydroxy-11-methylbenz(a)anthracene82735-50-0(10R-trans)-11-Methyl-10,11-dihydrobenz(a)anthracene-10,11-diolBenz(a)anthracene-10,11-diol, 10,11-dihydro-11-methyl-, (10R-trans)-
Database identifiers
- CAS
82735-50-0- PubChem CID
- 187337
- Nikkaji
- J616.132D
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 431
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…