| CAS Number | 2138060-60-1 |
| Catalog Number | AG01EIXY |
| Chemical Name | methyl 4-(fluorosulfonyl)pyridine-2-carboxylate |
| IUPAC Name | methyl 4-fluorosulfonylpyridine-2-carboxylate |
| InChI | InChI=1S/C7H6FNO4S/c1-13-7(10)6-4-5(2-3-9-6)14(8,11)12/h2-4H,1H3 |
| InChI Key | PAPXUAMKCVSOGA-UHFFFAOYSA-N |
| MDL Number | MFCD31559339 |
| Molecular Formula | C7H6FNO4S |
| Molecular Weight | 219.1902 |
| SMILES | COC(C1=NC=CC(S(F)(=O)=O)=C1)=O |
| Synonyms | methyl 4-(fluorosulfonyl)pyridine-2-carboxylate,
ES-2295,
2138060-60-1,
|
| Complexity | 310 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.186g/mol |
| Monoisotopic Mass | 219g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 81.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number