Benz[a]anthracene-5-methanol, 7,12-dimethyl-
Basic information
- CAS
34698-68-5- Standard SMILES
Cc1c2ccccc2c(C)c2c1cc(CO)c1ccccc12- InChIKey
RRHBLJOZQYJMCR-UHFFFAOYSA-N- Molecular formula
- C21H18O
- Average molar mass
- 286.4 g/mol
- Monoisotopic mass
- 286.13576519
Names & identifiers
- Preferred name
- Benz[a]anthracene-5-methanol, 7,12-dimethyl-
- IUPAC
- (7,12-dimethylbenzo[a]anthracen-5-yl)methanol
Names & synonyms
34698-68-5Benz[a]anthracene-5-methanol, 7,12-dimethyl-NSC172524DTXSID80305888NSC-172524(7,12-dimethyltetraphen-5-yl)methanolBenz[a]anthracene-5-methanol,12-dimethyl-DS-006449
Database identifiers
- CAS
34698-68-5- PubChem CID
- 299453
- DTXSID
DTXSID80305888
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 391
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…