| CAS Number | 1060804-15-0 |
| Catalog Number | AG00956L |
| Chemical Name | 5-Cyano-3-Pyridinesulfonyl chloride |
| IUPAC Name | 5-cyanopyridine-3-sulfonyl chloride |
| InChI | InChI=1S/C6H3ClN2O2S/c7-12(10,11)6-1-5(2-8)3-9-4-6/h1,3-4H |
| InChI Key | RZNCBFTUKKMELY-UHFFFAOYSA-N |
| MDL Number | MFCD13189095 |
| Molecular Formula | C6H3ClN2O2S |
| Molecular Weight | 202.6182 |
| SMILES | C1=C(C=NC=C1S(=O)(=O)Cl)C#N |
| Synonyms | 5-CYANOPYRIDINE-3-SULFONYL CHLORIDE,
1060804-15-0,
5-CYANO-3-PYRIDINESULFONYL CHLORIDE,
SCHEMBL3068730,
FCH927785,
5-Cyano-3-Pyridinesulfonyl chloride,
AKOS006333730,
ZINC101649875,
AB67736,
DB-015011,
FT-0765858,
EN300-216921,
|
| Complexity | 299 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.96g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.612g/mol |
| Monoisotopic Mass | 201.96g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 79.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number