| CAS Number | 1250921-74-4 |
| Catalog Number | AG01A48Z(AGN-PC-0WO7RG) |
| Chemical Name | 1-[2-(2-methoxyethyl)-4-methyl-1,3-thiazol-5-yl]ethan-1-one |
| IUPAC Name | 1-[2-(2-methoxyethyl)-4-methyl-1,3-thiazol-5-yl]ethanone |
| InChI | InChI=1S/C9H13NO2S/c1-6-9(7(2)11)13-8(10-6)4-5-12-3/h4-5H2,1-3H3 |
| InChI Key | WBVOJSFFNUEFDW-UHFFFAOYSA-N |
| MDL Number | MFCD14649864 |
| Molecular Formula | C9H13NO2S |
| Molecular Weight | 199.2700 |
| SMILES | COCCC1SC(C(C)=O)=C(C)N=1 |
| Synonyms | 1-[2-(2-methoxyethyl)-4-methyl-1,3-thiazol-5-yl]ethan-1-one,
1250921-74-4,
ZINC42350143,
AKOS010289351,
NE20561,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.268g/mol |
| Monoisotopic Mass | 199.067g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 67.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number