| CAS Number | 928730-23-8 |
| Catalog Number | AG00IHDH(AGN-PC-0WOKGU) |
| Chemical Name | 3-Chloro-4-methoxy-N-methylbenzenesulfonamide |
| IUPAC Name | 3-chloro-4-methoxy-N-methylbenzenesulfonamide |
| InChI | InChI=1S/C8H10ClNO3S/c1-10-14(11,12)6-3-4-8(13-2)7(9)5-6/h3-5,10H,1-2H3 |
| InChI Key | VRYLEXBBCVIISK-UHFFFAOYSA-N |
| MDL Number | MFCD05817679 |
| Molecular Formula | C8H10ClNO3S |
| Molecular Weight | 235.6879 |
| SMILES | CNS(C1=CC(Cl)=C(OC)C=C1)(=O)=O |
| Synonyms | 3-chloro-4-methoxy-N-methylbenzenesulfonamide,
928730-23-8,
AC1LJ2D9,
ZINC581567,
AKOS000426373,
3-chloro-4-methoxy-N-methylbenzene-1-sulfonamide,
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| Complexity | 275 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235.007g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.682g/mol |
| Monoisotopic Mass | 235.007g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 63.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number