| CAS Number | 438585-95-6 |
| Catalog Number | AG019T79(AGN-PC-030H4J) |
| Chemical Name | 5-(3-fluorophenyl)-1,3-thiazol-2-amine |
| IUPAC Name | 5-(3-fluorophenyl)-1,3-thiazol-2-amine |
| InChI | InChI=1S/C9H7FN2S/c10-7-3-1-2-6(4-7)8-5-12-9(11)13-8/h1-5H,(H2,11,12) |
| InChI Key | IUYAPOXGFKGVCS-UHFFFAOYSA-N |
| MDL Number | MFCD11846734 |
| Molecular Formula | C9H7FN2S |
| Molecular Weight | 194.2287 |
| SMILES | c1(cccc(c1)F)c1cnc(s1)N |
| Synonyms | 5-(3-fluorophenyl)-1,3-thiazol-2-amine,
438585-95-6,
5-(3-Fluorophenyl)thiazol-2-amine,
2-AMINO-5-(3-FLUOROPHENYL)-THIAZOLE,
SCHEMBL2406300,
ZINC38069133,
AKOS010253883,
2-Thiazolamine, 5-(3-fluorophenyl)-,
SC-30796,
|
| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.031g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.227g/mol |
| Monoisotopic Mass | 194.031g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 67.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
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Certificate of Analysis
Lot Number