Dibenzo(j,xyz)heptaphene
Basic information
- CAS
192-46-1- Standard SMILES
c1ccc2cc3c(cc2c1)cc1c2ccccc2c2cc4cc5ccccc5cc4c4ccc3c1c42- InChIKey
KADSIADUIOVQLQ-UHFFFAOYSA-N- Molecular formula
- C36H20
- Average molar mass
- 452.5 g/mol
- Monoisotopic mass
- 452.15650064
Names & identifiers
- Preferred name
- Dibenzo(j,xyz)heptaphene
- IUPAC
- nonacyclo[18.14.2.02,11.04,9.013,35.014,19.022,31.024,29.032,36]hexatriaconta-1(35),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32(36),33-octadecaene
Names & synonyms
DIBENZO(J,XYZ)HEPTAPHENEDibenzo[j,xyz]heptaphene192-46-1DTXSID30172749RefChem:132838DTXCID1095240KADSIADUIOVQLQ-UHFFFAOYSA-N
Database identifiers
- CAS
192-46-1- PubChem CID
- 9120
- DTXSID
DTXSID30172749- Nikkaji
- J1.557.840H
Properties
Computed structural properties
- XLogP
- 10.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 760
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…