| CAS Number | 1262412-30-5 |
| Catalog Number | AG009F0K(AGN-PC-0ACAGV) |
| Chemical Name | 5-bromo-3-fluoro-2-(trifluoromethyl)pyridine |
| IUPAC Name | 5-bromo-3-fluoro-2-(trifluoromethyl)pyridine |
| InChI | InChI=1S/C6H2BrF4N/c7-3-1-4(8)5(12-2-3)6(9,10)11/h1-2H |
| InChI Key | ZYPJKTSNQGVERF-UHFFFAOYSA-N |
| MDL Number | MFCD16875531 |
| Molecular Formula | C6H2BrF4N |
| Molecular Weight | 243.9844 |
| SMILES | FC(C1=NC=C(Br)C=C1F)(F)F |
| Synonyms | 5-bromo-3-fluoro-2-(trifluoromethyl)pyridine,
1262412-30-5,
5-Bromo-3-fluoro-2-(trifluoromethyl)pyridine, 97%,
SCHEMBL15674471,
DTXSID70716747,
ZYPJKTSNQGVERF-UHFFFAOYSA-N,
3366AD,
MFCD16875531,
ZINC66324269,
AKOS005258792,
AS-43255,
X-4018,
5-Bromo-3-fluoro-2-(trifluoromethyl)pyridine, AldrichCPR,
C6H2BrF4N,
|
| 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 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number