| CAS Number | 953894-41-2 |
| Catalog Number | AG01EIBJ |
| Chemical Name | N-methyl-2,3-dihydro-1-benzofuran-5-sulfonamide |
| IUPAC Name | N-methyl-2,3-dihydro-1-benzofuran-5-sulfonamide |
| InChI | InChI=1S/C9H11NO3S/c1-10-14(11,12)8-2-3-9-7(6-8)4-5-13-9/h2-3,6,10H,4-5H2,1H3 |
| InChI Key | AZCZGIDTBGQRNI-UHFFFAOYSA-N |
| MDL Number | MFCD09727766 |
| Molecular Formula | C9H11NO3S |
| Molecular Weight | 213.2535 |
| SMILES | CNS(C1=CC2=C(OCC2)C=C1)(=O)=O |
| Synonyms | N-METHYL-2,3-DIHYDRO-1-BENZOFURAN-5-SULFONAMIDE,
953894-41-2,
CTK6I5789,
ZINC22161860,
AKOS000137153,
Z53038398,
|
| Complexity | 296 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 213.046g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 213.251g/mol |
| Monoisotopic Mass | 213.046g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 63.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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Certificate of Analysis
Lot Number