Basic information
- CAS
60968-01-6- Standard SMILES
C1=Cc2c(ccc3cc4ccccc4cc23)CC1- InChIKey
UWODATFVIWARKW-UHFFFAOYSA-N- Molecular formula
- C18H14
- Average molar mass
- 230.3 g/mol
- Monoisotopic mass
- 230.10955045
Names & identifiers
- Preferred name
- BENZ(a)ANTHRACENE, 3,4-DIHYDRO-
- IUPAC
- 3,4-dihydrobenzo[a]anthracene
- English name
- 3,4-Dihydrobenz[a]anthracene
- Molecular formula
- C18H14
- Molecular weight
- 230.3
Names & synonyms
BENZ(a)ANTHRACENE, 3,4-DIHYDRO-3,4-dihydrobenz[a]anthracene3,4-Dihydrobenz(a)anthracene60968-01-63,4-Dihydrobenzo(a)anthraceneBRN 44009373,4-dihydrotetrapheneSCHEMBL3413516DTXSID20209816DB-304107Benz[a]anthracene, 3,4-dihydro-
Database identifiers
- CAS
60968-01-6- PubChem CID
- 43512
- DTXSID
DTXSID20209816- Nikkaji
- J73.184F
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 329
Physicochemical properties
- Boiling point
- 307.3 °C · 307.3°C (rough estimate)
- Density
- 1.0829 · 1.0829 (estimate)
- refractive index
- 1.55 · 1.5500 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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