| CAS Number | 1017141-27-3 |
| Catalog Number | AG01A8OK(AGN-PC-0WO432) |
| Chemical Name | 2-(5-chlorothiophene-2-sulfonamido)acetic acid |
| IUPAC Name | 2-[(5-chlorothiophen-2-yl)sulfonylamino]acetic acid |
| InChI | InChI=1S/C6H6ClNO4S2/c7-4-1-2-6(13-4)14(11,12)8-3-5(9)10/h1-2,8H,3H2,(H,9,10) |
| InChI Key | YXYBBYUNQLAKFT-UHFFFAOYSA-N |
| MDL Number | MFCD09892560 |
| Molecular Formula | C6H6ClNO4S2 |
| Molecular Weight | 255.6991 |
| SMILES | OC(CNS(C1SC(Cl)=CC=1)(=O)=O)=O |
| Synonyms | 2-(5-chlorothiophene-2-sulfonamido)acetic acid,
1017141-27-3,
AC1Q7638,
ZINC11888695,
AKOS008942756,
MCULE-2773637806,
NE37785,
NCGC00322568-01,
EN300-62180,
AB01318155-02,
Z45658598,
|
| Complexity | 312 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.943g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 255.687g/mol |
| Monoisotopic Mass | 254.943g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 120A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number