AC1NPY3O
[3,4,5-triacetyloxy-6-[(2-nitrophenyl)carbamothioylamino]oxan-2-yl]methyl acetate
Also Known As: [3,4,5-triacetyloxy-6-[(2-nitrophenyl)carbamothioylamino]oxan-2-yl]methyl acetate|2,3,4,6-Tetra-O-acetyl-N-[(2-nitrophenyl)carbamothioyl]hexopyranosylamine|[3,5-diacetyloxy-2-(acetyloxymethyl)-6-[(2-nitrophenyl)thiocarbamoylamino]oxan-4-yl] Acetate|3,5-diacetyloxy-6-(acetyloxymethyl)-2-({[(2-nitrophenyl)amino]thioxomethyl}ami no)-2H-3,4,5,6-tetrahydropyran-4-yl acetate
CAS: 6487-92-9
| Molecular Formula | C21H25N3O11S |
|---|---|
| Molecular Weight | 527.121 g/mol |
| LogP | 0.9643 |
| Topological Polar Surface Area | 181.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 8 |
| Exact Mass | 527.121 |
| Monoisotopic Mass | 527.121 |
| Heavy Atoms | 36 |
| Complexity | 1034.1156 |
Chemical Identifiers
| CAS Number | 6487-92-9 |
|---|---|
| SMILES | CC(=O)OCC1C(C(C(C(O1)NC(=S)NC2=CC=CC=C2[N+](=O)[O-])OC(=O)C)OC(=O)C)OC(=O)C |
Product Overview
AC1NPY3O (CAS 6487-92-9), with molecular formula C21H25N3O11S and molecular weight 527.121 g/mol. IUPAC: [3,4,5-triacetyloxy-6-[(2-nitrophenyl)carbamothioylamino]oxan-2-yl]methyl acetate.
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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