Basic information
- CAS
72648-44-3- Standard SMILES
Cc1c2ccccc2c(C)c2c3c(ccc12)C=CCC3- InChIKey
FOLBQIIBISWEKI-UHFFFAOYSA-N- Molecular formula
- C20H18
- Average molar mass
- 258.4 g/mol
- Monoisotopic mass
- 258.14085057
Names & identifiers
- Preferred name
- Benz(a)anthracene, 1,2-dihydro-7,12-dimethyl-
- IUPAC
- 7,12-dimethyl-1,2-dihydrobenzo[a]anthracene
Names & synonyms
BRN 4437273BENZ(a)ANTHRACENE, 1,2-DIHYDRO-7,12-DIMETHYL-1,2-Dihydro-7,12-dimethylbenz(a)anthracene72648-44-3DTXSID10222958RefChem:321011DTXCID40145449CHEMBL4410677,12-dimethyl-1,2-dihydrotetraphene
Database identifiers
- CAS
72648-44-3- PubChem CID
- 51666
- DTXSID
DTXSID10222958- ChEMBL
CHEMBL441067
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 381
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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