| CAS Number | 1621962-58-0 |
| Catalog Number | AG01ALYT |
| Chemical Name | dimethyl[(pyridin-3-yl)imino]-lambda6-sulfanone |
| IUPAC Name | dimethyl-oxo-pyridin-3-ylimino-λ6-sulfane |
| InChI | InChI=1S/C7H10N2OS/c1-11(2,10)9-7-4-3-5-8-6-7/h3-6H,1-2H3 |
| InChI Key | WIBVPBDFKFWUEG-UHFFFAOYSA-N |
| MDL Number | MFCD30486456 |
| Molecular Formula | C7H10N2OS |
| Molecular Weight | 170.2321 |
| SMILES | CS(C)(=NC1=CN=CC=C1)=O |
| Synonyms | ZINC307582842,
dimethyl[(pyridin-3-yl)imino]-lambda6-sulfanone,
1621962-58-0,
|
| Complexity | 223 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 170.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.23g/mol |
| Monoisotopic Mass | 170.051g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 50.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number