| CAS Number | 1305712-95-1 |
| Catalog Number | AG019ROF |
| Chemical Name | 5-Bromo-2,4-dimethoxybenzene-1-sulfonamide |
| IUPAC Name | 5-bromo-2,4-dimethoxybenzenesulfonamide |
| InChI | InChI=1S/C8H10BrNO4S/c1-13-6-4-7(14-2)8(3-5(6)9)15(10,11)12/h3-4H,1-2H3,(H2,10,11,12) |
| InChI Key | LLHWXUKOROGFKV-UHFFFAOYSA-N |
| MDL Number | MFCD18089640 |
| Molecular Formula | C8H10BrNO4S |
| Molecular Weight | 296.1383 |
| SMILES | COC1=C(Br)C=C(S(N)(=O)=O)C(OC)=C1 |
| Synonyms | 5-bromo-2,4-dimethoxybenzene-1-sulfonamide,
1305712-95-1,
AC1Q48X7,
ZINC58041542,
NE28299,
EN300-90071,
|
| Complexity | 302 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 294.951g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 296.135g/mol |
| Monoisotopic Mass | 294.951g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 87A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number