| CAS Number | 1805123-62-9 |
| Catalog Number | AG01B1R1(AGN-PC-0WOS80) |
| Chemical Name | 6-Bromo-2-(trifluoromethyl)pyridin-3-amine |
| IUPAC Name | 6-bromo-2-(trifluoromethyl)pyridin-3-amine |
| InChI | InChI=1S/C6H4BrF3N2/c7-4-2-1-3(11)5(12-4)6(8,9)10/h1-2H,11H2 |
| InChI Key | WOKKPJCRAHUJTP-UHFFFAOYSA-N |
| MDL Number | MFCD20923788 |
| Molecular Formula | C6H4BrF3N2 |
| Molecular Weight | 241.0086 |
| SMILES | NC1=C(C(F)(F)F)N=C(Br)C=C1 |
| Synonyms | 6-Bromo-2-(trifluoromethyl)pyridin-3-amine,
1805123-62-9,
ZINC95929672,
AKOS022176237,
FCH1613381,
AJ-135657,
3-Amino-6-bromo-2-(trifluoromethyl)pyridine,
EN300-173083,
|
| Complexity | 161 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.951g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.011g/mol |
| Monoisotopic Mass | 239.951g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number