Basic information
- CAS
65463-81-2- Standard SMILES
NC(=O)C1=NN(c2cccc(Cl)c2)C(=O)C1- InChIKey
DMQYRTQMXGJEEY-UHFFFAOYSA-N- Molecular formula
- C10H8ClN3O2
- Average molar mass
- 237.64 g/mol
- Monoisotopic mass
- 237.0305042
Names & identifiers
- Preferred name
- 1-(3-Chlorophenyl)-5-oxo-4,5-dihydro-1H-pyrazole-3-carboxamide
- IUPAC
- 1-(3-chlorophenyl)-5-oxo-4H-pyrazole-3-carboxamide
Names & synonyms
65463-81-2DTXSID605350851-(3-Chlorophenyl)-5-oxo-4,5-dihydro-1H-pyrazole-3-carboxamide
Database identifiers
- CAS
65463-81-2- PubChem CID
- 13292003
- DTXSID
DTXSID60535085
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 75.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 356
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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