| CAS Number | 923126-56-1 |
| Catalog Number | AG019K35 |
| Chemical Name | 2-bromo-4,5-dimethoxy-N-methylbenzene-1-sulfonamide |
| IUPAC Name | 2-bromo-4,5-dimethoxy-N-methylbenzenesulfonamide |
| InChI | InChI=1S/C9H12BrNO4S/c1-11-16(12,13)9-5-8(15-3)7(14-2)4-6(9)10/h4-5,11H,1-3H3 |
| InChI Key | DDLOQCYMDABSIK-UHFFFAOYSA-N |
| MDL Number | MFCD08444342 |
| Molecular Formula | C9H12BrNO4S |
| Molecular Weight | 310.1649 |
| SMILES | CNS(C1=C(Br)C=C(OC)C(OC)=C1)(=O)=O |
| Synonyms | 2-bromo-4,5-dimethoxy-N-methylbenzene-1-sulfonamide,
2-bromo-4,5-dimethoxy-N-methylbenzenesulfonamide,
923126-56-1,
AC1PM3OL,
AC1Q41BT,
CTK6J5312,
ZINC8055043,
AKOS009013783,
MCULE-2041914428,
NE40245,
EN300-25352,
Z90682791,
ZINC08055043,
CID9186307,
|
| Complexity | 316 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 308.967g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 310.162g/mol |
| Monoisotopic Mass | 308.967g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 73A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number