| CAS Number | 51270-39-4 |
| Catalog Number | AG01AUK4(AGN-PC-0NIASB) |
| Chemical Name | 1-bromo-N,N-dimethylmethanesulfonamide |
| IUPAC Name | 1-bromo-N,N-dimethylmethanesulfonamide |
| InChI | InChI=1S/C3H8BrNO2S/c1-5(2)8(6,7)3-4/h3H2,1-2H3 |
| InChI Key | MVZNJIOTIDUDMN-UHFFFAOYSA-N |
| MDL Number | MFCD25984861 |
| Molecular Formula | C3H8BrNO2S |
| Molecular Weight | 202.0701 |
| SMILES | CN(S(CBr)(=O)=O)C |
| Synonyms | 1-bromo-N,N-dimethylmethanesulfonamide,
51270-39-4,
SCHEMBL3579516,
ZINC39194087,
AKOS021404836,
Methanesulfonamide, 1-bromo-N,N-dimethyl-,
Methanesulfonamide,1-bromo-N,N-dimethyl-,
|
| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.946g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.066g/mol |
| Monoisotopic Mass | 200.946g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 45.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number