| CAS Number | 115719-94-3 |
| Catalog Number | AG01B7MU(AGN-PC-0JP617) |
| Chemical Name | N-tert-butyl-1-chloromethanesulfonamide |
| IUPAC Name | N-tert-butyl-1-chloromethanesulfonamide |
| InChI | InChI=1S/C5H12ClNO2S/c1-5(2,3)7-10(8,9)4-6/h7H,4H2,1-3H3 |
| InChI Key | VZAHIKRUKJZYOE-UHFFFAOYSA-N |
| MDL Number | MFCD09865763 |
| Molecular Formula | C5H12ClNO2S |
| Molecular Weight | 185.6723 |
| NSC Number | 135443 |
| SMILES | C(C)(C)(C)NS(=O)(=O)CCl |
| Synonyms | N-tert-butyl-1-chloromethanesulfonamide,
115719-94-3,
NSC135443,
Methanesulfonamide, 1-chloro-N-(1,1-dimethylethyl)-,
SCHEMBL2422228,
VZAHIKRUKJZYOE-UHFFFAOYSA-N,
ZINC1722016,
AKOS012977026,
MCULE-5841875573,
NSC-135443,
N-tert-butyl-C-chloro-methanesulfonamide,
N-(TERT-BUTYL)(CHLORO)METHANESULFONAMIDE,
AC1L5W1M,
CID282245,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.027727g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.67g/mol |
| Monoisotopic Mass | 185.027727g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 54.6Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number