| CAS Number | 285135-56-0 |
| Catalog Number | AG01A37D(AGN-PC-0WO37M) |
| Chemical Name | 6-sulfamoylpyridine-3-carboxylic acid |
| IUPAC Name | 6-sulfamoylpyridine-3-carboxylic acid |
| InChI | InChI=1S/C6H6N2O4S/c7-13(11,12)5-2-1-4(3-8-5)6(9)10/h1-3H,(H,9,10)(H2,7,11,12) |
| InChI Key | KUGDGAKDFIXCAL-UHFFFAOYSA-N |
| MDL Number | MFCD18902445 |
| Molecular Formula | C6H6N2O4S |
| Molecular Weight | 202.1878 |
| SMILES | O=C(C1=CC=C(S(=O)(N)=O)N=C1)O |
| Synonyms | 6-sulfamoylpyridine-3-carboxylic acid,
285135-56-0,
6-Sulfamoylnicotinic acid,
SCHEMBL4648030,
6-(Aminosulfonyl)nicotinic acid,
ZINC70453844,
AKOS005363098,
NE21461,
3-Pyridinecarboxylic acid, 6-(aminosulfonyl)-,
Z1891772533,
6-Sulfamoyl-nicotinic acid,
|
| Complexity | 294 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.005g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.184g/mol |
| Monoisotopic Mass | 202.005g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 119A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number