| CAS Number | 2060063-40-1 |
| Catalog Number | AG01B71R |
| Chemical Name | [4-(Dimethylamino)phenyl](imino)methyl-lambda6-sulfanone |
| IUPAC Name | N,N-dimethyl-4-(methylsulfonimidoyl)aniline |
| InChI | InChI=1S/C9H14N2OS/c1-11(2)8-4-6-9(7-5-8)13(3,10)12/h4-7,10H,1-3H3 |
| InChI Key | QNLKOBPMWNOTLE-UHFFFAOYSA-N |
| MDL Number | MFCD30497522 |
| Molecular Formula | C9H14N2OS |
| Molecular Weight | 198.2853 |
| SMILES | CN(C1=CC=C(S(C)(=O)=N)C=C1)C |
| Synonyms | [4-(dimethylamino)phenyl](imino)methyl-lambda6-sulfanone,
2060063-40-1,
|
| Complexity | 261 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 198.083g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.284g/mol |
| Monoisotopic Mass | 198.083g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 52.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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Certificate of Analysis
Lot Number