| CAS Number | 184644-83-5 |
| Catalog Number | AG007S2T(AGN-PC-030LBE) |
| Chemical Name | Sodium (2-Sulfonatoethyl)methanethiosulfonate |
| IUPAC Name | sodium;2-methylsulfonylsulfanylethanesulfonate |
| InChI | InChI=1S/C3H8O5S3.Na/c1-10(4,5)9-2-3-11(6,7)8;/h2-3H2,1H3,(H,6,7,8);/q;+1/p-1 |
| InChI Key | NZSYKLNULKPWIX-UHFFFAOYSA-M |
| MDL Number | MFCD00270075 |
| Molecular Formula | C3H7NaO5S3 |
| Molecular Weight | 242.2695 |
| SMILES | [O-]S(CCSS(C)(=O)=O)(=O)=O.[Na+] |
| Synonyms | MTSES,
Sodium (2-sulfonatoethyl)methanethiosulfonate,
184644-83-5,
AC1MQXGS,
Sodium 2-methylsulfonylsulfanylethanesulfonate,
CTK8G3132,
DTXSID00393166,
AKOS030255621,
RT-015729,
FT-0674624,
FT-0701114,
J-011831,
2-(Methylsulfonylthio)ethanesulfonic acid sodium salt,
2-[(Methylsulfonyl)thio]ethanesulfonic Acid Sodium Salt,
CID3509088,
CID6099472,
sodium(2-sulfonatoethyl)methanethiosulfonate,
155450-07-0,
|
| Complexity | 292 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.935g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.254g/mol |
| Monoisotopic Mass | 241.935g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 133A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number