| CAS Number | 926268-83-9 |
| Catalog Number | AG019YBC(AGN-PC-0WO6FJ) |
| Chemical Name | 2-(N-methylethanesulfonamido)acetic acid |
| IUPAC Name | 2-[ethylsulfonyl(methyl)amino]acetic acid |
| InChI | InChI=1S/C5H11NO4S/c1-3-11(9,10)6(2)4-5(7)8/h3-4H2,1-2H3,(H,7,8) |
| InChI Key | OLAMHKTVMOHSFJ-UHFFFAOYSA-N |
| MDL Number | MFCD09050994 |
| Molecular Formula | C5H11NO4S |
| Molecular Weight | 181.2101 |
| SMILES | CCS(N(CC(O)=O)C)(=O)=O |
| Synonyms | 2-(N-methylethanesulfonamido)acetic acid,
926268-83-9,
SCHEMBL13406336,
ZINC22151085,
AKOS000134282,
MCULE-6122561158,
NE38116,
Z53825854,
|
| Complexity | 227 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.206g/mol |
| Monoisotopic Mass | 181.041g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 83.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number