| CAS Number | 1216139-03-5 |
| Catalog Number | AG01C2MF |
| Chemical Name | 4-bromo-5-methoxy-2-methyl-1,3-thiazole |
| IUPAC Name | 4-bromo-5-methoxy-2-methyl-1,3-thiazole |
| InChI | InChI=1S/C5H6BrNOS/c1-3-7-4(6)5(8-2)9-3/h1-2H3 |
| InChI Key | UFPAUVNWSDZXTR-UHFFFAOYSA-N |
| MDL Number | MFCD13188451 |
| Molecular Formula | C5H6BrNOS |
| Molecular Weight | 208.0762 |
| SMILES | COC1=C(Br)N=C(C)S1 |
| Synonyms | 4-Bromo-5-methoxy-2-methyl-1,3-thiazole,
1216139-03-5,
ZINC40544431,
|
| Complexity | 103 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 206.935g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.073g/mol |
| Monoisotopic Mass | 206.935g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 50.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number