| CAS Number | 923129-16-2 |
| Catalog Number | AG0067ZM(AGN-PC-0WO8GW) |
| Chemical Name | 3-(N-Cyclopropylsulfamoyl)thiophene-2-carboxylic acid |
| IUPAC Name | 3-(cyclopropylsulfamoyl)thiophene-2-carboxylic acid |
| InChI | InChI=1S/C8H9NO4S2/c10-8(11)7-6(3-4-14-7)15(12,13)9-5-1-2-5/h3-5,9H,1-2H2,(H,10,11) |
| InChI Key | LMYZTCQLGNOUQX-UHFFFAOYSA-N |
| MDL Number | MFCD08444271 |
| Molecular Formula | C8H9NO4S2 |
| Molecular Weight | 247.2914 |
| SMILES | OC(C1=C(S(NC2CC2)(=O)=O)C=CS1)=O |
| Synonyms | 3-[(cyclopropylamino)sulfonyl]thiophene-2-carboxylic acid,
923129-16-2,
MCULE-6451387256,
NE59950,
RT-008924,
EN300-24486,
Z199040720,
NZ9,
3-(Cyclopropylsulfamoyl)thiophene-2-Carboxylic Acid,
3-(N-Cyclopropylsulfamoyl)thiophene-2-carboxylic acid,
4kza,
CTK5H1135,
DTXSID20585384,
AC1Q7262,
ZINC9494329,
AKOS004121970,
|
| Complexity | 357 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 246.997g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 247.283g/mol |
| Monoisotopic Mass | 246.997g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 120A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number