| CAS Number | 203731-38-8 |
| Catalog Number | AG01DW5H(AGN-PC-0NDMQ1) |
| Chemical Name | 2,3-Dichloro-5-(methylsulfonyl)pyridine |
| IUPAC Name | 2,3-dichloro-5-methylsulfonylpyridine |
| InChI | InChI=1S/C6H5Cl2NO2S/c1-12(10,11)4-2-5(7)6(8)9-3-4/h2-3H,1H3 |
| InChI Key | CKEHZBXHXCACMG-UHFFFAOYSA-N |
| MDL Number | MFCD27947061 |
| Molecular Formula | C6H5Cl2NO2S |
| Molecular Weight | 226.0804 |
| SMILES | O=S(C1=CN=C(Cl)C(Cl)=C1)(C)=O |
| Synonyms | 2,3-dichloro-5-(methylsulfonyl)pyridine,
203731-38-8,
SCHEMBL3716202,
CKEHZBXHXCACMG-UHFFFAOYSA-N,
2,3-Dichloro-5-methylsulfonylpyridine,
Pyridine, 2,3-dichloro-5-(methylsulfonyl)-,
2,3-dichloro-5-methylsulfonyl-pyridine,
CID10966194,
|
| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.942g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.071g/mol |
| Monoisotopic Mass | 224.942g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 55.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number