| CAS Number | 1155997-93-5 |
| Catalog Number | AG019VHZ(AGN-PC-0WOCOD) |
| Chemical Name | 5-[(3-fluorophenyl)methyl]-4-methyl-1,3-thiazol-2-amine |
| IUPAC Name | 5-[(3-fluorophenyl)methyl]-4-methyl-1,3-thiazol-2-amine |
| InChI | InChI=1S/C11H11FN2S/c1-7-10(15-11(13)14-7)6-8-3-2-4-9(12)5-8/h2-5H,6H2,1H3,(H2,13,14) |
| InChI Key | YXCGPFIAEVMHEW-UHFFFAOYSA-N |
| MDL Number | MFCD12096060 |
| Molecular Formula | C11H11FN2S |
| Molecular Weight | 222.2818 |
| SMILES | FC=1C=C(C=CC1)CC1=C(N=C(S1)N)C |
| Synonyms | 5-[(3-fluorophenyl)methyl]-4-methyl-1,3-thiazol-2-amine,
1155997-93-5,
AC1Q2F07,
CTK7C1844,
SBB084303,
ZINC35250900,
AKOS005217300,
MCULE-7748495557,
NE41210,
EN300-45296,
Z374075842,
5-[(3-fluorophenyl)methyl]-4-methyl-1,3-thiazole-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 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number