| CAS Number | 1516140-99-0 |
| Catalog Number | AG01AFYK |
| Chemical Name | Sodium oxane-4-sulfinate |
| IUPAC Name | sodium;oxane-4-sulfinate |
| InChI | InChI=1S/C5H10O3S.Na/c6-9(7)5-1-3-8-4-2-5;/h5H,1-4H2,(H,6,7);/q;+1/p-1 |
| InChI Key | JIOKFXIXTDFEIS-UHFFFAOYSA-M |
| MDL Number | MFCD24113367 |
| Molecular Formula | C5H9NaO3S |
| Molecular Weight | 172.1779 |
| SMILES | O1CCC(CC1)S(=O)[O-].[Na+] |
| Synonyms | sodium oxane-4-sulfinate,
1516140-99-0,
Sodium tetrahydropyransulfinate,
Tetrahydro-2H-pyran-4-sulfinic acid sodium salt,
|
| Complexity | 114 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.017g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.174g/mol |
| Monoisotopic Mass | 172.017g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 68.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
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