| CAS Number | 1935654-61-7 |
| Catalog Number | AG01DTFC |
| Chemical Name | 1-(3-methoxy-1,2-thiazol-5-yl)ethan-1-one |
| IUPAC Name | 1-(3-methoxy-1,2-thiazol-5-yl)ethanone |
| InChI | InChI=1S/C6H7NO2S/c1-4(8)5-3-6(9-2)7-10-5/h3H,1-2H3 |
| InChI Key | GSIGLGBGYKKNKH-UHFFFAOYSA-N |
| MDL Number | MFCD31559776 |
| Molecular Formula | C6H7NO2S |
| Molecular Weight | 157.1903 |
| SMILES | COC1=NSC(C(C)=O)=C1 |
| Synonyms | 1-(3-methoxy-1,2-thiazol-5-yl)ethan-1-one,
1935654-61-7,
|
| Complexity | 140 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 157.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 157.187g/mol |
| Monoisotopic Mass | 157.02g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number