| CAS Number | 34911-90-5 |
| Catalog Number | AG01BVOG |
| Chemical Name | sodium 3-methoxy-3-oxopropane-1-sulfonate |
| IUPAC Name | sodium;3-methoxy-3-oxopropane-1-sulfonate |
| InChI | InChI=1S/C4H8O5S.Na/c1-9-4(5)2-3-10(6,7)8;/h2-3H2,1H3,(H,6,7,8);/q;+1/p-1 |
| InChI Key | IFFQZJVFPBPAQU-UHFFFAOYSA-M |
| MDL Number | MFCD24248603 |
| Molecular Formula | C4H7NaO5S |
| Molecular Weight | 190.1501 |
| SMILES | [Na+].COC(CCS([O-])(=O)=O)=O |
| Synonyms | Sodium 3-methoxy-3-oxopropane-1-sulfonate,
34911-90-5,
SCHEMBL1736044,
IFFQZJVFPBPAQU-UHFFFAOYSA-M,
Z2684295464,
|
| Complexity | 203 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.991g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.145g/mol |
| Monoisotopic Mass | 189.991g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 91.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number