| CAS Number | 1702059-31-1 |
| Catalog Number | AG01BDKE(AGN-PC-0WOS4U) |
| Chemical Name | 4-methoxy-6-(trifluoromethyl)pyridin-3-amine |
| IUPAC Name | 4-methoxy-6-(trifluoromethyl)pyridin-3-amine |
| InChI | InChI=1S/C7H7F3N2O/c1-13-5-2-6(7(8,9)10)12-3-4(5)11/h2-3H,11H2,1H3 |
| InChI Key | KKDNXPAWWBBTED-UHFFFAOYSA-N |
| MDL Number | MFCD28023631 |
| Molecular Formula | C7H7F3N2O |
| Molecular Weight | 192.1385 |
| SMILES | COC1=C(N)C=NC(C(F)(F)F)=C1 |
| Synonyms | 4-methoxy-6-(trifluoromethyl)pyridin-3-amine,
1702059-31-1,
ZINC97054126,
AKOS026742222,
5-Amino-4-methoxy-2-(trifluoromethyl)pyridine,
|
| Complexity | 174 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 192.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 192.141g/mol |
| Monoisotopic Mass | 192.051g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 48.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number