Basic information
- CAS
18054-62-1- Standard SMILES
O=C1N=C(c2ccccc2)C(c2ccccc2)=N1- InChIKey
OTLLZASEKLGFMH-UHFFFAOYSA-N- Molecular formula
- C15H10N2O
- Average molar mass
- 234.25 g/mol
- Monoisotopic mass
- 234.07931295
Names & identifiers
- Preferred name
- 4,5-Diphenyl-2H-imidazol-2-one
- IUPAC
- 4,5-diphenylimidazol-2-one
- English name
- 4,5-diphenyl-2H-imidazol-2-one
- Molecular formula
- C15H10N2O
- Molecular weight
- 234.25
Names & synonyms
4,5-Diphenyl-2H-imidazol-2-one4,5-diphenylimidazol-2-one18054-62-176CMH3R7TM2H-Imidazol-2-one, 4,5-diphenyl-EINECS 241-968-6UNII-76CMH3R7TMNSC 142571NSC-142571DTXSID2075134RefChem:96552DTXCID1035731
Show more names
241-968-6NSC1425714,5-Diphenyl-imidazolon4,5-Diphenyl-imidazol-2-oneSCHEMBL4633787DB-338477NS00025941
Database identifiers
- CAS
18054-62-1- PubChem CID
- 73136
- DTXSID
DTXSID2075134- UNII
- 76CMH3R7TM
- EC Number
- 241-968-6
- Nikkaji
- J86.086G
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 349
Physicochemical properties
- Boiling point
- 374 · 374.0±25.0 °C(Predicted)
- Density
- 1.19 · 1.19±0.1 g/cm3(Predicted)
- pka
- -1.45 · -1.45±0.20(Predicted)
- FDA UNII
- 76 CMH3R7TM · 76CMH3R7TM
- EPA Substance Registry System
- 4 · 4,5-Diphenyl-2H-imidazol-2-one (18054-62-1)
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
2 records
Compound notes
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