2,3,5-Triphenylcyclohexa-2,5-diene-1,4-dione
Basic information
- CAS
22954-61-6- Standard SMILES
O=C1C=C(c2ccccc2)C(=O)C(c2ccccc2)=C1c1ccccc1- InChIKey
KHXDUUIFQRMZRK-UHFFFAOYSA-N- Molecular formula
- C24H16O2
- Average molar mass
- 336.4 g/mol
- Monoisotopic mass
- 336.11502975
Names & identifiers
- Preferred name
- 2,3,5-Triphenylcyclohexa-2,5-diene-1,4-dione
- IUPAC
- 2,3,5-triphenylcyclohexa-2,5-diene-1,4-dione
Names & synonyms
2,3,5-triphenylcyclohexa-2,5-diene-1,4-dione22954-61-6DTXSID40306078RefChem:244223DTXCID30257207triphenyl-quinoneNSC174002SCHEMBL28443720NSC-1740022~4~-Phenyl[1~1~,2~1~:2~2~,3~1~-terphenyl]-2~3~,2~6~-dione
Database identifiers
- CAS
22954-61-6- PubChem CID
- 299980
- DTXSID
DTXSID40306078
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 606
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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