| CAS Number | 1250073-44-9 |
| Catalog Number | AG01B2ZW |
| Chemical Name | 1,1-Dioxothiane-4-sulfonamide |
| IUPAC Name | 1,1-dioxothiane-4-sulfonamide |
| InChI | InChI=1S/C5H11NO4S2/c6-12(9,10)5-1-3-11(7,8)4-2-5/h5H,1-4H2,(H2,6,9,10) |
| InChI Key | JMFNEDGXMKPKKZ-UHFFFAOYSA-N |
| MDL Number | MFCD16671902 |
| Molecular Formula | C5H11NO4S2 |
| Molecular Weight | 213.2751 |
| SMILES | O=S(C(CC1)CCS1(=O)=O)(N)=O |
| Synonyms | 1,1-dioxothiane-4-sulfonamide,
1250073-44-9,
AKOS011365367,
1,1-dioxo-1lambda-thiane-4-sulfonamide,
|
| Complexity | 330 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 213.013g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 213.266g/mol |
| Monoisotopic Mass | 213.013g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 111A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.1 |
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Certificate of Analysis
Lot Number