| CAS Number | 1182913-23-0 |
| Catalog Number | AG0076TV(AGN-PC-0WCCQU) |
| Chemical Name | N-Isopropyl 4-bromo-3-methylbenzenesulfonamide |
| IUPAC Name | 4-bromo-3-methyl-N-propan-2-ylbenzenesulfonamide |
| InChI | InChI=1S/C10H14BrNO2S/c1-7(2)12-15(13,14)9-4-5-10(11)8(3)6-9/h4-7,12H,1-3H3 |
| InChI Key | JJKOYHPEPFTONV-UHFFFAOYSA-N |
| MDL Number | MFCD12515180 |
| Molecular Formula | C10H14BrNO2S |
| Molecular Weight | 292.1927 |
| SMILES | CC(NS(=O)(=O)c1ccc(c(c1)C)Br)C |
| Synonyms | 1182913-23-0,
4-Bromo-N-isopropyl-3-methylbenzenesulfonamide,
N-ISOPROPYL 4-BROMO-3-METHYLBENZENESULFONAMIDE,
4-Bromo-3-methyl-N-(propan-2-yl)benzene-1-sulfonamide,
ACMC-2099wl,
CTK4B0627,
DTXSID80681098,
ANW-17107,
MFCD12515180,
ZINC37382852,
AKOS008939165,
AJ-93847,
TR-034196,
ST24023430,
Z7893,
N-Isopropyl4-bromo-3-methylbenzenesulfonamide,
A-5243,
I01-10761,
C10H14BrNO2S,
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| Complexity | 297 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 290.993g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 292.191g/mol |
| Monoisotopic Mass | 290.993g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 54.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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