| CAS Number | 20055-00-9 |
| Catalog Number | AG01DZ8S(AGN-PC-0JTDDN) |
| Chemical Name | 1-Methyl-4-Nitro-1H-Pyrazol-3-Amine |
| IUPAC Name | 1-methyl-4-nitropyrazol-3-amine |
| InChI | InChI=1S/C4H6N4O2/c1-7-2-3(8(9)10)4(5)6-7/h2H,1H3,(H2,5,6) |
| InChI Key | ATPXGQVBSCIPET-UHFFFAOYSA-N |
| MDL Number | MFCD00463971 |
| Molecular Formula | C4H6N4O2 |
| Molecular Weight | 142.1160 |
| SMILES | CN1N=C(C(=C1)[N+](=O)[O-])N |
| Synonyms | 3-Amino-1-methyl-4-nitropyrazole,
20055-00-9,
AC1LBST5,
SCHEMBL8920036,
1-methyl-4-nitropyrazol-3-amine,
ATPXGQVBSCIPET-UHFFFAOYSA-N,
AKOS006341704,
1-Methyl-4-nitro-1H-pyrazol-3-amine,
1-Methyl-4-nitro-1H-pyrazol-3-amine #,
CID588383,
|
| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 142.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 142.118g/mol |
| Monoisotopic Mass | 142.049g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 89.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number