| CAS Number | 75230-51-2 |
| Catalog Number | AG01DTNX(AGN-PC-0U6WRS) |
| Chemical Name | Benzenesulfonic acid, 4-methyl-,[1-(4-bromophenyl)ethylidene]hydrazide |
| IUPAC Name | N-[1-(4-bromophenyl)ethylideneamino]-4-methylbenzenesulfonamide |
| InChI | InChI=1S/C15H15BrN2O2S/c1-11-3-9-15(10-4-11)21(19,20)18-17-12(2)13-5-7-14(16)8-6-13/h3-10,18H,1-2H3 |
| InChI Key | YEUAQVSDGAKESG-UHFFFAOYSA-N |
| MDL Number | MFCD03366048 |
| Molecular Formula | C15H15BrN2O2S |
| Molecular Weight | 367.2608 |
| SMILES | BrC1=CC=C(C=C1)C(C)=NNS(=O)(=O)C1=CC=C(C=C1)C |
| Synonyms | N'-(1-(4-Bromophenyl)ethylidene)-4-methylbenzenesulfonohydrazide,
75230-51-2,
AC1LR0YI,
ZINC03969059,
MCULE-3015520319,
N-[1-(4-bromophenyl)ethylideneamino]-4-methylbenzenesulfonamide,
ZINC01202870,
CID1360476,
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| Complexity | 457 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 366.004g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 367.261g/mol |
| Monoisotopic Mass | 366.004g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 66.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number