| CAS Number | 154064-98-9 |
| Catalog Number | AG01FFT0(AGN-PC-3H4ADP) |
| Chemical Name | 2-Chloro-5-sulfamoyl-thiophene-3-carboxylic acid |
| IUPAC Name | 2-chloro-5-sulfamoylthiophene-3-carboxylic acid |
| InChI | InChI=1S/C5H4ClNO4S2/c6-4-2(5(8)9)1-3(12-4)13(7,10)11/h1H,(H,8,9)(H2,7,10,11) |
| InChI Key | AUWCFDJPONYYGM-UHFFFAOYSA-N |
| MDL Number | MFCD01859821 |
| Molecular Formula | C5H4ClNO4S2 |
| Molecular Weight | 241.6726 |
| SMILES | OC(=O)c1cc(sc1Cl)S(=O)(=O)N |
| Synonyms | 2-chloro-5-sulfamoyl-thiophene-3-carboxylic Acid,
5-(aminosulfonyl)-2-chloro-3-thiophenecarboxylic acid,
154064-98-9,
SCHEMBL9429522,
CTK8C6621,
AUWCFDJPONYYGM-UHFFFAOYSA-N,
ZINC967482,
AKOS015855149,
DA-09904,
5-chloro-4-carboxythiophene-2-sulfonamide,
TC-063449,
FT-0748681,
CID1201498,
|
| Complexity | 311 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.927g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.66g/mol |
| Monoisotopic Mass | 240.927g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 134A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number