| CAS Number | 874007-76-8 |
| Catalog Number | AG01B9IX |
| Chemical Name | 6-Sulfamoylhexanoic Acid |
| IUPAC Name | 6-sulfamoylhexanoic acid |
| InChI | InChI=1S/C6H13NO4S/c7-12(10,11)5-3-1-2-4-6(8)9/h1-5H2,(H,8,9)(H2,7,10,11) |
| InChI Key | NSKZKCIYKKBCAS-UHFFFAOYSA-N |
| MDL Number | MFCD20643038 |
| Molecular Formula | C6H13NO4S |
| Molecular Weight | 195.2367 |
| SMILES | S(N)(=O)(=O)CCCCCC(=O)O |
| Synonyms | 6-sulfamoylhexanoic acid,
874007-76-8,
SCHEMBL7606907,
ZINC80820087,
AKOS033755107,
Z2065788206,
|
| Complexity | 228 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.057g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.233g/mol |
| Monoisotopic Mass | 195.057g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 106A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number