Basic information
- CAS
7189-06-2- Standard SMILES
O=C(c1ccccc1)c1cn(-c2ccccc2)nc1-c1ccccc1- InChIKey
FVOKDMDUQWBUOE-UHFFFAOYSA-N- Molecular formula
- C22H16N2O
- Average molar mass
- 324.4 g/mol
- Monoisotopic mass
- 324.12626314
Names & identifiers
- Preferred name
- Ketone, 1,3-diphenylpyrazol-4-yl phenyl
- IUPAC
- (1,3-diphenylpyrazol-4-yl)-phenylmethanone
- English name
- (1,3-diphenyl-1H-pyrazol-4-yl)(phenyl)methanone
- Molecular formula
- C22H16N2O
- Molecular weight
- 324.37524
Names & synonyms
7189-06-2Ketone, 1,3-diphenylpyrazol-4-yl phenyl1,3-Diphenyl-4-benzoylpyrazoleDTXSID10222150RefChem:350369DTXCID10144641(1,3-diphenyl-1H-pyrazol-4-yl)(phenyl)methanone(1,3-diphenylpyrazol-4-yl)-phenylmethanoneAE-842/32538017
Database identifiers
- CAS
7189-06-2- PubChem CID
- 189191
- DTXSID
DTXSID10222150- Nikkaji
- J1.165.958F
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 433
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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