Basic information
- CAS
2554-35-0- Standard SMILES
CC1=NNC(=O)C1N=Nc1ccc(C)cc1- InChIKey
IEHUIUFRCOTUPN-UHFFFAOYSA-N- Molecular formula
- C11H12N4O
- Average molar mass
- 216.24 g/mol
- Monoisotopic mass
- 216.10111102
Names & identifiers
- Preferred name
- 3-Methyl-4-(p-tolylazo)-2-pyrazolin-5-one
- IUPAC
- 3-methyl-4-[(4-methylphenyl)diazenyl]-1,4-dihydropyrazol-5-one
Names & synonyms
3-Methyl-4-(p-tolylazo)-2-pyrazolin-5-oneF 23422-Pyrazolin-5-one, 3-methyl-4-(p-tolylazo)-4-(4'Tolyl-azo)-3-methyl-pyrazolon-(5) [German]2554-35-03H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-((4-methylphenyl)azo)-4-(4'Tolyl-azo)-3-methyl-pyrazolon-(5)
Database identifiers
- CAS
2554-35-0- PubChem CID
- 200705
- Nikkaji
- J1.515.411J
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 66.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 329
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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