| CAS Number | 1227602-97-2 |
| Catalog Number | AG01FR59(AGN-PC-0WCLAS) |
| Chemical Name | 3-Iodo-6-(trifluoromethyl)pyridin-2-amine |
| IUPAC Name | 3-iodo-6-(trifluoromethyl)pyridin-2-amine |
| InChI | InChI=1S/C6H4F3IN2/c7-6(8,9)4-2-1-3(10)5(11)12-4/h1-2H,(H2,11,12) |
| InChI Key | YRIMQSWLFUPHIK-UHFFFAOYSA-N |
| MDL Number | MFCD16606192 |
| Molecular Formula | C6H4F3IN2 |
| Molecular Weight | 288.0090 |
| SMILES | Ic1ccc(nc1N)C(F)(F)F |
| Synonyms | 2-amino-3-iodo-6-(trifluoromethyl)pyridine,
1227602-97-2,
ZINC238624189,
FCH1343512,
|
| Complexity | 161 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 287.93713g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 288.01g/mol |
| Monoisotopic Mass | 287.93713g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 38.9Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
Lot Number