| CAS Number | 1257329-71-7 |
| Catalog Number | AG01B860 |
| Chemical Name | 4-methyl-5-(trifluoromethyl)thiazol-2-amine |
| IUPAC Name | 4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine |
| InChI | InChI=1S/C5H5F3N2S/c1-2-3(5(6,7)8)11-4(9)10-2/h1H3,(H2,9,10) |
| InChI Key | URIRTMPDHCZFSA-UHFFFAOYSA-N |
| MDL Number | MFCD18909167 |
| Molecular Formula | C5H5F3N2S |
| Molecular Weight | 182.1668 |
| SMILES | CC1=C(C(F)(F)F)SC(N)=N1 |
| Synonyms | 1257329-71-7,
4-METHYL-5-(TRIFLUOROMETHYL)-1,3-THIAZOL-2-AMINE,
4-METHYL-5-(TRIFLUOROMETHYL)THIAZOL-2-AMINE,
ZINC95763996,
AKOS033714900,
AB76205,
SC-67264,
Z1983079325,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 182.013g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 182.164g/mol |
| Monoisotopic Mass | 182.013g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 67.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
Lot Number