| CAS Number | 123090-57-3 |
| Catalog Number | AG019KCX(AGN-PC-0WOD0Q) |
| Chemical Name | 2-(Pyridine-3-sulfonamido)acetic acid |
| IUPAC Name | 2-(pyridin-3-ylsulfonylamino)acetic acid |
| InChI | InChI=1S/C7H8N2O4S/c10-7(11)5-9-14(12,13)6-2-1-3-8-4-6/h1-4,9H,5H2,(H,10,11) |
| InChI Key | ATIOLTOEDAOGRD-UHFFFAOYSA-N |
| MDL Number | MFCD08691338 |
| Molecular Formula | C7H8N2O4S |
| Molecular Weight | 216.2144 |
| SMILES | OC(CNS(C1=CN=CC=C1)(=O)=O)=O |
| Synonyms | 2-(pyridine-3-sulfonamido)acetic acid,
123090-57-3,
[(pyridin-3-ylsulfonyl)amino]acetic acid,
AC1Q763Y,
ZINC12505227,
AKOS000202995,
MCULE-6107063847,
NE14010,
NCGC00335554-01,
EN300-26423,
AB01327944-02,
Z271099572,
|
| Complexity | 295 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.211g/mol |
| Monoisotopic Mass | 216.02g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 105A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number