AC1MJ4R3
3-methyl-4-[(4-methyl-3-nitrophenyl)diazenyl]-5-oxo-4H-pyrazole-1-carbothioamide
Also Known As: BAS 00417417|4-({3-nitro-4-methylphenyl}diazenyl)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-carbothioamide|AG-690/11354139|AG-690/11960897|SR-01000356830-1|3-methyl-4-[(4-methyl-3-nitrophenyl)diazenyl]-5-oxo-4H-pyrazole-1-carbothioamide
CAS: 313270-89-2
| Molecular Formula | C12H12N6O3S |
|---|---|
| Molecular Weight | 320.06915 g/mol |
| LogP | 1.81722 |
| Topological Polar Surface Area | 126.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.06915 |
| Monoisotopic Mass | 320.06915 |
| Heavy Atoms | 22 |
| Complexity | 729.57184 |
Chemical Identifiers
| CAS Number | 313270-89-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N=NC2C(=NN(C2=O)C(=S)N)C)[N+](=O)[O-] |
Product Overview
AC1MJ4R3 (CAS 313270-89-2), with molecular formula C12H12N6O3S and molecular weight 320.06915 g/mol. IUPAC: 3-methyl-4-[(4-methyl-3-nitrophenyl)diazenyl]-5-oxo-4H-pyrazole-1-carbothioamide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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