| CAS Number | 926188-02-5 |
| Catalog Number | AG019U9K |
| Chemical Name | 5-(2,3,4-Trifluorobenzyl)-1,3-thiazol-2-amine |
| IUPAC Name | 5-[(2,3,4-trifluorophenyl)methyl]-1,3-thiazol-2-amine |
| InChI | InChI=1S/C10H7F3N2S/c11-7-2-1-5(8(12)9(7)13)3-6-4-15-10(14)16-6/h1-2,4H,3H2,(H2,14,15) |
| InChI Key | FCGFLMKPFPJGAV-UHFFFAOYSA-N |
| MDL Number | MFCD08442924 |
| Molecular Formula | C10H7F3N2S |
| Molecular Weight | 244.2362 |
| SMILES | NC1SC(CC2=C(F)C(F)=C(F)C=C2)=CN=1 |
| Synonyms | 5-[(2,3,4-trifluorophenyl)methyl]-1,3-thiazol-2-amine,
5-(2,3,4-trifluorobenzyl)-1,3-thiazol-2-amine,
926188-02-5,
CTK7E1151,
ZINC21952296,
AKOS000126164,
MCULE-4317523587,
NE49527,
5-(2,3,4-trifluorobenzyl)thiazol-2-amine,
EN300-41005,
AB01001875-01,
Z228586472,
AC1Q52UD,
|
| Complexity | 244 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.028204g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.24g/mol |
| Monoisotopic Mass | 244.028204g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.2Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number