| CAS Number | 1188168-84-4 |
| Catalog Number | AG01BTIH |
| Chemical Name | 2-chloro-4-(4-fluorophenyl)-5-methyl-1,3-thiazole |
| IUPAC Name | 2-chloro-4-(4-fluorophenyl)-5-methyl-1,3-thiazole |
| InChI | InChI=1S/C10H7ClFNS/c1-6-9(13-10(11)14-6)7-2-4-8(12)5-3-7/h2-5H,1H3 |
| InChI Key | RUIKHWZBAYPUIB-UHFFFAOYSA-N |
| MDL Number | MFCD11220141 |
| Molecular Formula | C10H7ClFNS |
| Molecular Weight | 227.6857 |
| SMILES | CC1=C(C2=CC=C(F)C=C2)N=C(Cl)S1 |
| Synonyms | 1188168-84-4,
2-chloro-4-(4-fluorophenyl)-5-methyl-1,3-thiazole,
ZINC61714208,
AKOS012241360,
2-chloro-4-(4-fluorophenyl)-5-methylthiazole,
|
| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.997g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.681g/mol |
| Monoisotopic Mass | 226.997g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.1 |
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Certificate of Analysis
Lot Number