| CAS Number | 1955524-08-9 |
| Catalog Number | AG01C4TD |
| Chemical Name | Ethyl 2-(2-bromo-5-methylthiazol-4-yl)acetate |
| IUPAC Name | ethyl 2-(2-bromo-5-methyl-1,3-thiazol-4-yl)acetate |
| InChI | InChI=1S/C8H10BrNO2S/c1-3-12-7(11)4-6-5(2)13-8(9)10-6/h3-4H2,1-2H3 |
| InChI Key | XVMVXJBBUWTRJC-UHFFFAOYSA-N |
| MDL Number | MFCD29762451 |
| Molecular Formula | C8H10BrNO2S |
| Molecular Weight | 264.1395 |
| SMILES | O=C(OCC)CC1=C(C)SC(Br)=N1 |
| Synonyms | Ethyl 2-(2-bromo-5-methylthiazol-4-yl)acetate,
1955524-08-9,
ethyl 2-(2-bromo-5-methyl-1,3-thiazol-4-yl)acetate,
ZINC259941659,
56355-62-5,
|
| Complexity | 191 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 262.962g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 264.137g/mol |
| Monoisotopic Mass | 262.962g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 67.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number