Basic information
- CAS
60968-08-3- Standard SMILES
C1=Cc2ccc3cc4ccccc4cc3c2CC1- InChIKey
QAOBWUDWTZDFAO-UHFFFAOYSA-N- Molecular formula
- C18H14
- Average molar mass
- 230.3 g/mol
- Monoisotopic mass
- 230.10955045
Names & identifiers
- Preferred name
- Benz(a)anthracene, 1,2-dihydro-
- IUPAC
- 1,2-dihydrobenzo[a]anthracene
- English name
- 1,2-Dihydrobenz[a]anthracene
- Molecular formula
- C18H14
- Molecular weight
- 230.3
Names & synonyms
60968-08-3BENZ(a)ANTHRACENE, 1,2-DIHYDRO-1,2-dihydrobenzo[a]anthracene1,2-Dihydrobenz(a)anthracene1,2-Dihydrobenzo(a)anthraceneBRN 19550801,2-Dihydrobenz[a]anthraceneDTXSID40209818RefChem:321010DTXCID901323091,2-dihydrotetraphenedihydrobenz[a]anthracene
Show more names
Benz[a]anthracene, 1,2-dihydro-
1,2-Dihydro-benz[a]anthraceneSCHEMBL3418047SCHEMBL29801033DB-300972
Database identifiers
- CAS
60968-08-3- PubChem CID
- 43513
- DTXSID
DTXSID40209818- Nikkaji
- J73.183H
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)
- solubility
- Ethyl Acetate
- form
- Solid
- color
- Yellow
Chemistry & industry
Applications
Uses1,2-Dihydro-benz[a]anthracene is an intermediate of Benz[a]anthracene-1r,2t,3c,4t-tetrahydro-1,2,3,4-tetrol (B183585), which is an immunosuppressor and a laboratory carcinogen.
Suppliers1 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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