Basic information
- CAS
193-11-3- Standard SMILES
c1ccc2cc3cc4c(cc3cc2c1)c1cccc2ccc3cccc4c3c21- InChIKey
JQUQARYITFQBHD-UHFFFAOYSA-N- Molecular formula
- C28H16
- Average molar mass
- 352.4 g/mol
- Monoisotopic mass
- 352.12520051
Names & identifiers
- Preferred name
- Dibenzo(DE,UV)pentacene
- IUPAC
- heptacyclo[14.10.2.02,15.04,13.06,11.020,28.023,27]octacosa-1(26),2,4,6,8,10,12,14,16,18,20(28),21,23(27),24-tetradecaene
Names & synonyms
DIBENZO(DE,UV)PENTACENEDibenzo[de,uv]pentacene193-11-3SCHEMBL4845145DTXSID40172896
Database identifiers
- CAS
193-11-3- PubChem CID
- 9130
- DTXSID
DTXSID40172896- Nikkaji
- J1.550.952J
Properties
Computed structural properties
- XLogP
- 8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 541
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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