1,5-Diphenyl-4-((4-methylphenyl)azo)-1H-pyrazole
Basic information
- CAS
40640-33-3- Standard SMILES
Cc1ccc(N=Nc2cnn(-c3ccccc3)c2-c2ccccc2)cc1- InChIKey
LTJFTRQWCGSCDS-UHFFFAOYSA-N- Molecular formula
- C22H18N4
- Average molar mass
- 338.4 g/mol
- Monoisotopic mass
- 338.15314659
Names & identifiers
- Preferred name
- 1,5-Diphenyl-4-((4-methylphenyl)azo)-1H-pyrazole
- IUPAC
- (1,5-diphenylpyrazol-4-yl)-(4-methylphenyl)diazene
Names & synonyms
BRN 06869951,5-Diphenyl-4-((4-methylphenyl)azo)-1H-pyrazole1H-Pyrazole, 1,5-diphenyl-4-((4-methylphenyl)azo)-5-25-18-00140 (Beilstein Handbook Reference)40640-33-3
Database identifiers
- CAS
40640-33-3- PubChem CID
- 218455
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 445
Related reactions
0 records
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Compound notes
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