| CAS Number | 22133-00-2 |
| Catalog Number | AG01B73P |
| Chemical Name | (3-chlorophenyl)(imino)methyl-lambda6-sulfanone |
| IUPAC Name | (3-chlorophenyl)-imino-methyl-oxo-λ6-sulfane |
| InChI | InChI=1S/C7H8ClNOS/c1-11(9,10)7-4-2-3-6(8)5-7/h2-5,9H,1H3 |
| InChI Key | QULXQZIRHOOTOZ-UHFFFAOYSA-N |
| MDL Number | MFCD30345143 |
| Molecular Formula | C7H8ClNOS |
| Molecular Weight | 189.6625 |
| SMILES | CS(C1=CC(Cl)=CC=C1)(=O)=N |
| Synonyms | (3-chlorophenyl)(imino)methyl-lambda6-sulfanone,
22133-00-2,
|
| Complexity | 235 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.002g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.657g/mol |
| Monoisotopic Mass | 189.002g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number