| CAS Number | 923133-90-8 |
| Catalog Number | AG019M1H(AGN-PC-0WOBTF) |
| Chemical Name | 5-[(3-Fluoro-4-methylphenyl)methyl]-1,3-thiazol-2-amine |
| IUPAC Name | 5-[(3-fluoro-4-methylphenyl)methyl]-1,3-thiazol-2-amine |
| InChI | InChI=1S/C11H11FN2S/c1-7-2-3-8(5-10(7)12)4-9-6-14-11(13)15-9/h2-3,5-6H,4H2,1H3,(H2,13,14) |
| InChI Key | ZIQWUWHGNUWGBS-UHFFFAOYSA-N |
| MDL Number | MFCD08444647 |
| Molecular Formula | C11H11FN2S |
| Molecular Weight | 222.2818 |
| SMILES | CC1=C(F)C=C(CC2SC(N)=NC=2)C=C1 |
| Synonyms | 5-(3-fluoro-4-methylbenzyl)-1,3-thiazol-2-amine,
5-[(3-fluoro-4-methylphenyl)methyl]-1,3-thiazol-2-amine,
923133-90-8,
AC1Q2FFI,
CTK7E1149,
SBB084152,
ZINC12480500,
AKOS000134298,
MCULE-2519688028,
NE13888,
5-(3-fluoro-4-methylbenzyl)thiazol-2-amine,
EN300-33735,
5-[(3-fluoro-4-methylphenyl)methyl]-1,3-thiazole-2-ylamine,
5-(3-Fluoro-4-methyl-benzyl)-thiazol-2-ylamine,
|
| Complexity | 215 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.281g/mol |
| Monoisotopic Mass | 222.063g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number