O,O-Bis(2-fluoro-2,2-bis(hydroxy(oxido)amino)ethyl) thiocarbonate
bis(2-fluoro-2,2-dinitroethoxy)methanethione
Also Known As: O,O-Bis(2-fluoro-2,2-bis(hydroxy(oxido)amino)ethyl) thiocarbonate|bis(2-fluoro-2,2-dinitro-ethoxy)methanethione|bis(2-fluoro-2,2-dinitroethoxy)methanethione|NCI60_002693|bis(2-fluoro-2,2-dinitroethyl)thionocarbonate|O,O-Bis(2-fluoro-2,2-dinitroethyl) carbonothioate|O,O-Bis(2-fluoro-2,2-dinitroethyl) thiocarbonate|Carbonothioic acid, O,O-bis(2-fluoro-2,2-dinitroethyl) ester
CAS: 70096-91-2
| Molecular Formula | C5H4F2N4O10S |
|---|---|
| Molecular Weight | 349.9616 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 234.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 349.9616 |
| Monoisotopic Mass | 349.9616 |
| Heavy Atoms | 22 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 70096-91-2 |
|---|---|
| SMILES | C(C([N+](=O)[O-])([N+](=O)[O-])F)OC(=S)OCC([N+](=O)[O-])([N+](=O)[O-])F |
| InChIKey | WMUNXAZWYPTWDQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Organic Building Blocks (11 patents)
Polymer Intermediates (2 patents)
Product Overview
O,O-Bis(2-fluoro-2,2-bis(hydroxy(oxido)amino)ethyl) thiocarbonate (CAS 70096-91-2), with molecular formula C5H4F2N4O10S and molecular weight 349.9616 g/mol. IUPAC: bis(2-fluoro-2,2-dinitroethoxy)methanethione.
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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