| CAS Number | 1349708-84-4 |
| Catalog Number | AG01F39Z(AGN-PC-3H48P1) |
| Chemical Name | 3-Bromo-5-fluoro-4-(trifluoromethyl)pyridine |
| IUPAC Name | 3-bromo-5-fluoro-4-(trifluoromethyl)pyridine |
| InChI | InChI=1S/C6H2BrF4N/c7-3-1-12-2-4(8)5(3)6(9,10)11/h1-2H |
| InChI Key | AIOCPXGMKDNVBZ-UHFFFAOYSA-N |
| MDL Number | MFCD19686170 |
| Molecular Formula | C6H2BrF4N |
| Molecular Weight | 243.9844 |
| SMILES | FC1=C(C(F)(F)F)C(Br)=CN=C1 |
| Synonyms | 1349708-84-4,
3-bromo-5-fluoro-4-(trifluoromethyl)pyridine,
3-Bromo-5-fluoro-4-trifluoromethylpyridine,
SCHEMBL19948241,
ZINC67802795,
AKOS027321874,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.931g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.987g/mol |
| Monoisotopic Mass | 242.931g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number