[(2R,3R,4R,5R)-3,4-diacetyloxy-5-(3,5-dioxo-1,2,4-triazin-2-yl)oxolan-2-yl]methyl acetate
[(2R,3R,4R,5R)-3,4-diacetyloxy-5-(3,5-dioxo-1,2,4-triazin-2-yl)oxolan-2-yl]methyl acetate
| Molecular Formula | C14H17N3O9 |
|---|---|
| Molecular Weight | 371.3 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 150.0 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 371.09647 |
| Heavy Atoms | 26 |
| Complexity | 662.0 |
Chemical Identifiers
| CAS Number | 2169-64-4 |
|---|---|
| SMILES | CC(=O)OCC1C(C(C(O1)N2C(=O)NC(=O)C=N2)OC(=O)C)OC(=O)C |
| InChIKey | QQOBRRFOVWGIMD-OJAKKHQRSA-N |
📖 Product Overview
[(2R,3R,4R,5R)-3,4-diacetyloxy-5-(3,5-dioxo-1,2,4-triazin-2-yl)oxolan-2-yl]methyl acetate (CAS: 2169-64-4) is a chemical compound with molecular formula C14H17N3O9 and molecular weight 371.3 g/mol. Its IUPAC systematic name is [(2R,3R,4R,5R)-3,4-diacetyloxy-5-(3,5-dioxo-1,2,4-triazin-2-yl)oxolan-2-yl]methyl acetate.
QQOBRRFOVWGIMD-OJAKKHQRSA-N.
SMILES: CC(=O)OCC1C(C(C(O1)N2C(=O)NC(=O)C=N2)OC(=O)C)OC(=O)C.
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