| CAS Number | 1007036-41-0 |
| Catalog Number | AG008TZP(AGN-PC-0WOLBA) |
| Chemical Name | Sodium 2-(4-methylthiazol-2-yl)acetate |
| IUPAC Name | sodium;2-(4-methyl-1,3-thiazol-2-yl)acetate |
| InChI | InChI=1S/C6H7NO2S.Na/c1-4-3-10-5(7-4)2-6(8)9;/h3H,2H2,1H3,(H,8,9);/q;+1/p-1 |
| InChI Key | RQEZRGOLVACBTR-UHFFFAOYSA-M |
| MDL Number | MFCD08246121 |
| Molecular Formula | C6H6NNaO2S |
| Molecular Weight | 179.1721 |
| SMILES | O=C(O[Na])CC1=NC(C)=CS1 |
| Synonyms | sodium (4-methyl-1,3-thiazol-2-yl)acetate,
1007036-41-0,
sodium 2-(4-methyl-1,3-thiazol-2-yl)acetate,
Sodium 2-(4-methylthiazol-2-yl)acetate,
AC1Q1VPG,
CTK5I4993,
AKOS009088964,
MCULE-6390824297,
NE13785,
EN300-24193,
Z190662872,
2-chloro-N-[4-(methylsulfonyl)phenyl]acetamide,
|
| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.002g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.169g/mol |
| Monoisotopic Mass | 179.002g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 81.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number