AC1L754Q
[4,5-diacetyloxy-6-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-2-(nitromethyl)oxan-3-yl] acetate
Also Known As: [4,5-diacetyloxy-6-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-2-(nitromethyl)oxan-3-yl] acetate|N,N-dimethyl-2-(methylsulfanyl)-9-(2,3,4-tri-O-acetyl-6-deoxy-6-nitrohexopyranosyl)-9H-purin-6-amine
CAS: 55263-63-3
| Molecular Formula | C20H26N6O9S |
|---|---|
| Molecular Weight | 526.1482 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 206.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 10 |
| Exact Mass | 526.1482 |
| Monoisotopic Mass | 526.1482 |
| Heavy Atoms | 36 |
| Complexity | 845.0 |
Chemical Identifiers
| CAS Number | 55263-63-3 |
|---|---|
| SMILES | CC(=O)OC1C(OC(C(C1OC(=O)C)OC(=O)C)N2C=NC3=C2N=C(N=C3N(C)C)SC)C[N+](=O)[O-] |
| InChIKey | NIWOETOITSXOJW-UHFFFAOYSA-N |
Product Overview
AC1L754Q (CAS 55263-63-3), with molecular formula C20H26N6O9S and molecular weight 526.1482 g/mol. IUPAC: [4,5-diacetyloxy-6-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-2-(nitromethyl)oxan-3-yl] 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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