1H-Pyrazole-3-carboxamide, 4,5-dihydro-5-oxo-1-phenyl-
Basic information
- CAS
6401-98-5- Standard SMILES
NC(=O)C1=NN(c2ccccc2)C(=O)C1- InChIKey
SPFXLCCBWAJCHQ-UHFFFAOYSA-N- Molecular formula
- C10H9N3O2
- Average molar mass
- 203.2 g/mol
- Monoisotopic mass
- 203.06947654
Names & identifiers
- Preferred name
- 1H-Pyrazole-3-carboxamide, 4,5-dihydro-5-oxo-1-phenyl-
- IUPAC
- 5-oxo-1-phenyl-4H-pyrazole-3-carboxamide
- English name
- 5-oxo-1-phenyl-2-pyrazoline-3-carboxamide
- Molecular formula
- C10H9N3O2
- Molecular weight
- 203.2
Names & synonyms
6401-98-51H-Pyrazole-3-carboxamide, 4,5-dihydro-5-oxo-1-phenyl-EINECS 229-015-2DTXSID7064310RefChem:438976DTXCID30441765-oxo-1-phenyl-4,5-dihydro-1h-pyrazole-3-carboxamide5-Oxo-1-phenyl-2-pyrazoline-3-carboxamide5-oxo-1-phenyl-4H-pyrazole-3-carboxamideRT2NK78FK7UNII-RT2NK78FK7SCHEMBL2857386
Show more names
3-Carbamoyl-1-Phenyl-5-Pyrazolone[3-(benzenesulfonyloxy)-6-sulfamoylnaphthalen-2-yl] benzenesulfonate
SCHEMBL95119404,5-Dihydro-5-oxo-1-phenyl-1H-pyrazole-3-carboxamideAKOS0049125411-phenyl-3-carbamoyl-2-pyrazolin-5-oneNS00035618SR-01000596964SR-01000596964-1
Database identifiers
- CAS
6401-98-5- PubChem CID
- 80813
- DTXSID
DTXSID7064310- UNII
- RT2NK78FK7
- EC Number
- 229-015-2
- Nikkaji
- J69.911J
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 75.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 319
Physicochemical properties
- FDA UNII
- 2 NK78FK7 · RT2NK78FK7
- EPA Substance Registry System
- 1 H-Pyrazole-3-carboxamide, · 1H-Pyrazole-3-carboxamide, 4,5-dihydro-5-oxo-1-phenyl- (6401-98-5)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1H-Pyrazole-3-carboxamide, 4,5-dihydro-5-oxo-1-phenyl-: INACTIVE
Upstream & downstream products
Downstream products
Suppliers
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Related reactions
1 records
Compound notes
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