| CAS Number | 210422-66-5 |
| Catalog Number | AG01DTSL(AGN-PC-0LB9N3) |
| Chemical Name | N'-[(E)-(4-fluorophenyl)methylidene]-4-methylbenzene-1-sulfonohydrazide |
| IUPAC Name | N-[(4-fluorophenyl)methylideneamino]-4-methylbenzenesulfonamide |
| InChI | InChI=1S/C14H13FN2O2S/c1-11-2-8-14(9-3-11)20(18,19)17-16-10-12-4-6-13(15)7-5-12/h2-10,17H,1H3 |
| InChI Key | OMBDHPYMTXWALU-UHFFFAOYSA-N |
| MDL Number | MFCD00415867 |
| Molecular Formula | C14H13FN2O2S |
| Molecular Weight | 292.3286 |
| SMILES | c1c(ccc(c1)/C=N/NS(=O)(=O)c1ccc(cc1)C)F |
| Synonyms | N'-(4-Fluorobenzylidene)-4-methylbenzenesulfonohydrazide,
210422-66-5,
AC1NBOY9,
MCULE-7186698588,
N-[(4-fluorophenyl)methylideneamino]-4-methylbenzenesulfonamide,
CID4446695,
N-[(4-fluorophenyl)methylideneamino]-4-methyl-benzenesulfonamide,
|
| Complexity | 417 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 292.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 292.328g/mol |
| Monoisotopic Mass | 292.068g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 66.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number