| CAS Number | 81792-84-9 |
| Catalog Number | AG0050MA(AGN-PC-0161W6) |
| Chemical Name | 4-Methoxy-2-nitrobenzenesulfonamide |
| IUPAC Name | 4-methoxy-2-nitrobenzenesulfonamide |
| InChI | InChI=1S/C7H8N2O5S/c1-14-5-2-3-7(15(8,12)13)6(4-5)9(10)11/h2-4H,1H3,(H2,8,12,13) |
| InChI Key | MELAWMCOLMMBNG-UHFFFAOYSA-N |
| MDL Number | MFCD09731192 |
| Molecular Formula | C7H8N2O5S |
| Molecular Weight | 232.2138 |
| SMILES | COC1=CC([N+]([O-])=O)=C(S(N)(=O)=O)C=C1 |
| Synonyms | 4-methoxy-2-nitrobenzenesulfonamide,
81792-84-9,
4-methoxy-2-nitrobenzene-1-sulfonamide,
Benzenesulfonamide, 4-methoxy-2-nitro-,
AC1Q47G4,
SCHEMBL6038599,
CTK3E3920,
DTXSID30588447,
ZINC22171811,
AKOS000141488,
MCULE-1902667988,
NE26255,
EN300-37276,
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| Complexity | 330 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.21g/mol |
| Monoisotopic Mass | 232.015g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 124A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number