| CAS Number | 68502-14-7 |
| Catalog Number | AG019PQ0 |
| Chemical Name | 4-(5-formylfuran-2-yl)-N-methylbenzene-1-sulfonamide |
| IUPAC Name | 4-(5-formylfuran-2-yl)-N-methylbenzenesulfonamide |
| InChI | InChI=1S/C12H11NO4S/c1-13-18(15,16)11-5-2-9(3-6-11)12-7-4-10(8-14)17-12/h2-8,13H,1H3 |
| InChI Key | UMXYHHTUJITSCV-UHFFFAOYSA-N |
| MDL Number | MFCD08444311 |
| Molecular Formula | C12H11NO4S |
| Molecular Weight | 265.2850 |
| SMILES | CNS(C1=CC=C(C2OC(C=O)=CC=2)C=C1)(=O)=O |
| Synonyms | 4-(5-formylfuran-2-yl)-N-methylbenzene-1-sulfonamide,
4-(5-formyl-2-furyl)-N-methylbenzenesulfonamide,
68502-14-7,
4-(5-Formylfuran-2-yl)-N-methylbenzenesulfonamide,
AC1Q41D7,
CTK6I5779,
MFCD08444311,
ZINC12505052,
AKOS030646703,
MCULE-6794900531,
NE33528,
EN300-24701,
|
| Complexity | 381 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 265.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 265.283g/mol |
| Monoisotopic Mass | 265.041g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 84.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number