| CAS Number | 1178102-52-7 |
| Catalog Number | AG01BEUK |
| Chemical Name | 1-(methylsulfamoyl)piperidine-4-carboxylic acid |
| IUPAC Name | 1-(methylsulfamoyl)piperidine-4-carboxylic acid |
| InChI | InChI=1S/C7H14N2O4S/c1-8-14(12,13)9-4-2-6(3-5-9)7(10)11/h6,8H,2-5H2,1H3,(H,10,11) |
| InChI Key | XYUZAPACTQJECK-UHFFFAOYSA-N |
| MDL Number | MFCD12798965 |
| Molecular Formula | C7H14N2O4S |
| Molecular Weight | 222.2621 |
| SMILES | CNS(N1CCC(C(O)=O)CC1)(=O)=O |
| Synonyms | 1-(methylsulfamoyl)piperidine-4-carboxylic acid,
1178102-52-7,
SCHEMBL15543574,
ZINC37655531,
AKOS010079269,
Z2065464288,
|
| Complexity | 300 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.259g/mol |
| Monoisotopic Mass | 222.067g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 95.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number