HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 5259755Generated: November 3, 2026
benzyl N-[4-[1-hydroxy-2-(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)-2-nitroethyl]-6-methoxy-2,2-dimethyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-yl]carbamate
https://huagongshe.com/en/chemical/5259755
Identifiers & Physical Properties
| CAS No. | 7241-97-6 |
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| Molecular formula | C27H38N2O13 |
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| Average molar mass | 598.6 g/mol |
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| Monoisotopic mass | 598.23738927 g/mol |
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| SMILES | COC1OC(C(O)C(C2OC(OC)C3OC(C)(C)OC32)[N+](=O)[O-])C2OC(C)(C)OC2C1NC(=O)OCc1ccccc1 |
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| InChIKey | ZUWYRALVUUTGTK-UHFFFAOYSA-N |
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| PubChem CID | 5259755 |
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| DTXSID | DTXSID40413918 |
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Chemical & Physical Properties
| XLogP | 0.8 |
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| Topological polar surface area | 178 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 13 |
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| Rotatable bonds | 9 |
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| Heavy atoms | 42 |
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| Formal charge | 0 |
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| Complexity | 970 |
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![benzyl N-[4-[1-hydroxy-2-(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)-2-nitroethyl]-6-methoxy-2,2-dimethyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-yl]carbamate molecular structure](/img/chemical/5259755.png)