| CAS Number | 1256562-26-1 |
| Catalog Number | AG00J2WQ |
| Chemical Name | 5-(Bromomethyl)-4-methylthiazole hydrobromide |
| IUPAC Name | 5-(bromomethyl)-4-methyl-1,3-thiazole;hydrobromide |
| InChI | InChI=1S/C5H6BrNS.BrH/c1-4-5(2-6)8-3-7-4;/h3H,2H2,1H3;1H |
| InChI Key | SOPJLBVOKUNTHO-UHFFFAOYSA-N |
| MDL Number | MFCD26937572 |
| Molecular Formula | C5H7Br2NS |
| Molecular Weight | 272.9888 |
| SMILES | Br.BrCC1=C(N=CS1)C |
| Synonyms | 5-(bromomethyl)-4-methyl-1,3-thiazole hydrobromide,
1256562-26-1,
SCHEMBL859049,
SOPJLBVOKUNTHO-UHFFFAOYSA-N,
ZX-CM010803,
MFCD26937572,
AKOS027426240,
5-(Bromomethyl)-4-methylthiazole hydrobromide,
181424-10-2,
|
| Complexity | 78.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 272.865g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 272.986g/mol |
| Monoisotopic Mass | 270.867g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number