| CAS Number | 1272667-54-5 |
| Catalog Number | AG00A170(AGN-PC-0WOVPM) |
| Chemical Name | 3,3-dimethyl-1lambda6-thiomorpholine-1,1-dione hydrochloride |
| IUPAC Name | 3,3-dimethyl-1,4-thiazinane 1,1-dioxide;hydrochloride |
| InChI | InChI=1S/C6H13NO2S.ClH/c1-6(2)5-10(8,9)4-3-7-6;/h7H,3-5H2,1-2H3;1H |
| InChI Key | SMFWFOPDXJPCTQ-UHFFFAOYSA-N |
| MDL Number | MFCD20688453 |
| Molecular Formula | C6H14ClNO2S |
| Molecular Weight | 199.6989 |
| SMILES | Cl.CC1(NCCS(=O)(=O)C1)C |
| Synonyms | 1272667-54-5,
3,3-Dimethyl-1lambda6-thiomorpholine-1,1-dione hydrochloride,
AKOS026744685,
NE16675,
3,3-dimethylthiomorpholine-1,1-dioxide hydrochloride,
3,3-dimethyl-1??,4-thiomorpholine-1,1-dione hydrochloride,
3,3-dimethyl-1lambda-thiomorpholine-1,1-dione hydrochloride,
|
| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.693g/mol |
| Monoisotopic Mass | 199.043g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 54.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number