| CAS Number | 1049726-64-8 |
| Catalog Number | AG019NWR |
| Chemical Name | 4-(Chloromethyl)-2-(4-ethylphenyl)-1,3-thiazole hydrochloride |
| IUPAC Name | 4-(chloromethyl)-2-(4-ethylphenyl)-1,3-thiazole;hydrochloride |
| InChI | InChI=1S/C12H12ClNS.ClH/c1-2-9-3-5-10(6-4-9)12-14-11(7-13)8-15-12;/h3-6,8H,2,7H2,1H3;1H |
| InChI Key | SRTIAOKLGSHUFO-UHFFFAOYSA-N |
| MDL Number | MFCD07290507 |
| Molecular Formula | C12H13Cl2NS |
| Molecular Weight | 274.2093 |
| SMILES | Cl.CCC1=CC=C(C2SC=C(CCl)N=2)C=C1 |
| Synonyms | 4-(chloromethyl)-2-(4-ethylphenyl)-1,3-thiazole hydrochloride,
1049726-64-8,
AC1Q39NQ,
MLS000417746,
CHEMBL1429971,
CTK6D1488,
AKOS030662833,
NE13501,
SMR000264588,
EN300-12023,
SR-01000698119,
SR-01000698119-2,
|
| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 273.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 274.203g/mol |
| Monoisotopic Mass | 273.015g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number