Basic information
- CAS
35281-25-5- Standard SMILES
c1ccc2c(c1)Cc1c(c3ccccc3c3ccccc13)C2- InChIKey
KLFMBPASUWJAGD-UHFFFAOYSA-N- Molecular formula
- C22H16
- Average molar mass
- 280.4 g/mol
- Monoisotopic mass
- 280.12520051
Names & identifiers
- Preferred name
- Benzo(b)triphenylene, 9,14-dihydro-
- IUPAC
- 9,14-dihydrobenzo[b]triphenylene
- English name
- 9,14-Dihydrobenzo[b]triphenylene
- Molecular formula
- C22H16
- Molecular weight
- 280.36
Names & synonyms
9,14-dihydrobenzo[b]triphenylene35281-25-59,14-Dihydrobenzo(b)triphenylene9,14-Dihydrodibenz(a,c)anthraceneBENZO(b)TRIPHENYLENE, 9,14-DIHYDRO-DTXSID10188767RefChem:326288DTXCID701112589,14-dihydrobenzo[f]tetraphene9,14-dihydrobenzo[b]triphenylenAKOS015905975Benzo[b]triphenylene, 9,14-dihydro-
Database identifiers
- CAS
35281-25-5- PubChem CID
- 37099
- DTXSID
DTXSID10188767- Nikkaji
- J65.940A
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 361
Physicochemical properties
- Melting point
- 205.5 · 205.5-206.5 °C(Solv: benzene (71-43-2))
- Boiling point
- 482.3 · 482.3±25.0 °C(Predicted)
- Density
- 1.196 · 1.196±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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