HuagongsheHuagongshe Chemistry Print Report · For research reference only
N-(2,2-Diethoxycarbonylvinyl)-2,3-O-isopropylidene-D-ribofuranosylamine
N-(2,2-diethoxycarbonylvinyl)-2,3-O-isopropylidene-D-ribofuranosylamine · Propanedioic acid, [[[2,3-O-(1-methylethylidene)-α-D-ribofuranosyl]amino]methylene]-, diethyl ester (9CI)

Identifiers & Physical Properties
| CAS No. | 157306-00-8 |
|---|---|
| Molecular formula | C16H25NO8 |
| Average molar mass | 359.37 g/mol |
| Monoisotopic mass | 359.15801676 g/mol |
| SMILES | CCOC(=O)C(=CN[C@H]1O[C@H](CO)C2OC(C)(C)OC21)C(=O)OCC |
| InChIKey | RTBHFFLEWRTMNG-XVSSEFHLSA-N |
| PubChem CID | 190874 |
| DTXSID | DTXSID90935655 |
Chemical & Physical Properties
| XLogP | 1.2 |
|---|---|
| Topological polar surface area | 113 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 9 |
| Rotatable bonds | 9 |
| Heavy atoms | 25 |
| Formal charge | 0 |
| Complexity | 512 |
| Boiling point | 451.1±45.0 °C(Predicted) |
| Density | 1.28±0.1 g/cm3(Predicted) |
| pKa (acidity coefficient) | 14.14±0.10(Predicted) |