| CAS Number | 1341720-23-7 |
| Catalog Number | AG01A25B(AGN-PC-0WOAWK) |
| Chemical Name | 4,4-Dimethylcyclohexane-1-sulfonamide |
| IUPAC Name | 4,4-dimethylcyclohexane-1-sulfonamide |
| InChI | InChI=1S/C8H17NO2S/c1-8(2)5-3-7(4-6-8)12(9,10)11/h7H,3-6H2,1-2H3,(H2,9,10,11) |
| InChI Key | OJKXYRPFRFQMNH-UHFFFAOYSA-N |
| MDL Number | MFCD20319918 |
| Molecular Formula | C8H17NO2S |
| Molecular Weight | 191.2911 |
| SMILES | CC1(CCC(S(N)(=O)=O)CC1)C |
| Synonyms | 4,4-dimethylcyclohexane-1-sulfonamide,
1341720-23-7,
ZINC70654768,
AKOS013722965,
NE49755,
|
| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.289g/mol |
| Monoisotopic Mass | 191.098g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 68.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number