Basic information
- CAS
111771-10-9- Standard SMILES
Cc1c2cc(F)ccc2c(C)c2c3c(ccc12)CCCC3- InChIKey
BXSNVZFABGUXTM-UHFFFAOYSA-N- Molecular formula
- C20H19F
- Average molar mass
- 278.4 g/mol
- Monoisotopic mass
- 278.14707877
Names & identifiers
- Preferred name
- Benz(a)anthracene, 1,2,3,4-tetrahydro-7,12-dimethyl-9-fluoro-
- IUPAC
- 9-fluoro-7,12-dimethyl-1,2,3,4-tetrahydrobenzo[a]anthracene
Names & synonyms
Benz(a)anthracene, 1,2,3,4-tetrahydro-7,12-dimethyl-9-fluoro-111771-10-9BRN 50758581,2,3,4-Tetrahydro-7,12-dimethyl-9-fluorobenz(a)anthraceneDTXSID201497239-fluoro-7,12-dimethyl-1,2,3,4-tetrahydrotetraphene
Database identifiers
- CAS
111771-10-9- PubChem CID
- 198697
- DTXSID
DTXSID20149723
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 378
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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