Basic information
- CAS
63041-95-2- Standard SMILES
Cc1ccc2c(c1)cc1ccc3cccc4c5ccccc5c2c1c34- InChIKey
UJDZXHMDIYKAMC-UHFFFAOYSA-N- Molecular formula
- C25H16
- Average molar mass
- 316.4 g/mol
- Monoisotopic mass
- 316.12520051
Names & identifiers
- Preferred name
- DIBENZO(def,p)CHRYSENE, 8-METHYL-
- IUPAC
- 19-methylhexacyclo[10.10.2.02,7.08,24.015,23.017,22]tetracosa-1(23),2,4,6,8,10,12(24),13,15,17(22),18,20-dodecaene
- English name
- 8-Methyldibenzo[def,p]chrysene
- Molecular formula
- C25H16
- Molecular weight
- 316.39
Names & synonyms
DIBENZO(def,p)CHRYSENE, 8-METHYL-7-Methyl-1:2:3:4-dibenzpyreneDTXSID7021237012-methylnaphtho[1,2,3,4-pqr]tetraphene8-Methyldibenzo[def,p]chryseneDibenzo[def,p]chrysene, 8-methyl-
Database identifiers
- CAS
63041-95-2- PubChem CID
- 44376
- DTXSID
DTXSID70212370
Properties
Computed structural properties
- XLogP
- 8.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 508
Physicochemical properties
- Boiling point
- 390.82 °C · 390.82°C (rough estimate)
- Density
- 1.1569 · 1.1569 (estimate)
- refractive index
- 1.843 · 1.8430 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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