| CAS Number | 792953-08-3 |
| Catalog Number | AG019MJN |
| Chemical Name | 5-amino-1-(2-nitrophenyl)-1H-pyrazole-4-carboxamide |
| IUPAC Name | 5-amino-1-(2-nitrophenyl)pyrazole-4-carboxamide |
| InChI | InChI=1S/C10H9N5O3/c11-9-6(10(12)16)5-13-14(9)7-3-1-2-4-8(7)15(17)18/h1-5H,11H2,(H2,12,16) |
| InChI Key | GZHBTVHPOBBMAU-UHFFFAOYSA-N |
| MDL Number | MFCD10686900 |
| Molecular Formula | C10H9N5O3 |
| Molecular Weight | 247.2102 |
| SMILES | NC(C1=C(N)N(C2=C([N+]([O-])=O)C=CC=C2)N=C1)=O |
| Synonyms | 5-amino-1-(2-nitrophenyl)-1H-pyrazole-4-carboxamide,
792953-08-3,
AC1Q4Z5V,
SCHEMBL1691871,
CTK5I3942,
GZHBTVHPOBBMAU-UHFFFAOYSA-N,
ZINC20283582,
AKOS027248158,
MCULE-4382658668,
NE19007,
EN300-36396,
Z370706838,
|
| Complexity | 345 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 247.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 247.214g/mol |
| Monoisotopic Mass | 247.071g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 133A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number