| CAS Number | 1313705-92-8 |
| Catalog Number | AG009F62(AGN-PC-0WQX4L) |
| Chemical Name | (4R)-4-t-Butyl-1,2,3-oxathiazolidine-2,2-dioxide-3-carboxylic acid t-butyl ester |
| IUPAC Name | tert-butyl (4R)-4-tert-butyl-2,2-dioxooxathiazolidine-3-carboxylate |
| InChI | InChI=1S/C11H21NO5S/c1-10(2,3)8-7-16-18(14,15)12(8)9(13)17-11(4,5)6/h8H,7H2,1-6H3/t8-/m0/s1 |
| InChI Key | HSGFAURARADKGN-QMMMGPOBSA-N |
| MDL Number | MFCD17018786 |
| Molecular Formula | C11H21NO5S |
| Molecular Weight | 279.3531 |
| SMILES | O=C(N1S(OC[C@H]1[C@](C)(C)C)(=O)=O)OC(C)(C)C |
| Synonyms | 1313705-92-8,
(4R)-4-t-Butyl-1,2,3-oxathiazolidine-2,2-dioxide-3-carboxylic acid t-butyl ester,
MFCD17018786,
ZINC96838037,
SB18573,
AS-51203,
(r)-3-boc-4-tert-butyl-2,2-dioxo-[1,2,3]oxathiazolidine,
(4R)-4-t-Butyl-1,2,3-oxathiazolidine-2,2-dioxide-3-carboxylic acid t-butyl ester, Min. 97%,
|
| Complexity | 424 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 279.114g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 279.351g/mol |
| Monoisotopic Mass | 279.114g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 81.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number