| CAS Number | 328028-07-5 |
| Catalog Number | AG019GIB |
| Chemical Name | 2-Hydroxy-4-(thiophene-2-sulfonylamino)-benzoic acid |
| IUPAC Name | 2-hydroxy-4-(thiophen-2-ylsulfonylamino)benzoic acid |
| InChI | InChI=1S/C11H9NO5S2/c13-9-6-7(3-4-8(9)11(14)15)12-19(16,17)10-2-1-5-18-10/h1-6,12-13H,(H,14,15) |
| InChI Key | IGOIDJWJGGCYCL-UHFFFAOYSA-N |
| MDL Number | MFCD02704600 |
| Molecular Formula | C11H9NO5S2 |
| Molecular Weight | 299.3229 |
| SMILES | OC(C1=C(O)C=C(NS(C2SC=CC=2)(=O)=O)C=C1)=O |
| Synonyms | 2-hydroxy-4-(thiophene-2-sulfonamido)benzoic acid,
328028-07-5,
2-Hydroxy-4-(thiophene-2-sulfonylamino)-benzoic acid,
AC1LJHGW,
AC1Q72HH,
Oprea1_216049,
2-hydroxy-4-(thiophen-2-ylsulfonylamino)benzoic Acid,
SCHEMBL9997150,
CTK7I8194,
ZINC615647,
AKOS000121798,
MCULE-2920071526,
NE34197,
EN300-00283,
Z56785461,
CID974604,
|
| Complexity | 433 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 298.992g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 299.315g/mol |
| Monoisotopic Mass | 298.992g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 140A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number