| CAS Number | 1306607-16-8 |
| Catalog Number | AG01AIFS(AGN-PC-0WO7CF) |
| Chemical Name | Methyl 5-(chlorosulfonyl)furan-3-carboxylate |
| IUPAC Name | methyl 5-chlorosulfonylfuran-3-carboxylate |
| InChI | InChI=1S/C6H5ClO5S/c1-11-6(8)4-2-5(12-3-4)13(7,9)10/h2-3H,1H3 |
| InChI Key | AUAUIWGJONUSDU-UHFFFAOYSA-N |
| MDL Number | MFCD18839058 |
| Molecular Formula | C6H5ClO5S |
| Molecular Weight | 224.6189 |
| SMILES | O=C(C1=COC(S(=O)(Cl)=O)=C1)OC |
| Synonyms | methyl 5-(chlorosulfonyl)furan-3-carboxylate,
1306607-16-8,
AKOS024095147,
ZINC100632884,
NE17737,
FT-0714189,
EN300-77688,
|
| Complexity | 293 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.955g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.611g/mol |
| Monoisotopic Mass | 223.955g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 82A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number