| CAS Number | 1017458-09-1 |
| Catalog Number | AG01A7J5(AGN-PC-0WOQCP) |
| Chemical Name | 3-amino-4-chloro-N-cyclopropylbenzene-1-sulfonamide |
| IUPAC Name | 3-amino-4-chloro-N-cyclopropylbenzenesulfonamide |
| InChI | InChI=1S/C9H11ClN2O2S/c10-8-4-3-7(5-9(8)11)15(13,14)12-6-1-2-6/h3-6,12H,1-2,11H2 |
| InChI Key | SXDQWWXNRZJEBB-UHFFFAOYSA-N |
| MDL Number | MFCD09900778 |
| Molecular Formula | C9H11ClN2O2S |
| Molecular Weight | 246.7138 |
| SMILES | NC1=C(Cl)C=CC(S(NC2CC2)(=O)=O)=C1 |
| Synonyms | 3-amino-4-chloro-N-cyclopropylbenzene-1-sulfonamide,
1017458-09-1,
CTK6H1243,
ZINC11801284,
AKOS009226983,
MCULE-4572384768,
NE35175,
EN300-58887,
Z951367646,
AC1Q50ZZ,
|
| Complexity | 324 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 246.022976g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 246.71g/mol |
| Monoisotopic Mass | 246.022976g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 80.6Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number