| CAS Number | 153617-04-0 |
| Catalog Number | AG019CGK(AGN-PC-0WBROL) |
| Chemical Name | 6-chloro-2,3-bis(trifluoromethyl)pyridine |
| IUPAC Name | 6-chloro-2,3-bis(trifluoromethyl)pyridine |
| InChI | InChI=1S/C7H2ClF6N/c8-4-2-1-3(6(9,10)11)5(15-4)7(12,13)14/h1-2H |
| InChI Key | PBCADMHKCLFSJK-UHFFFAOYSA-N |
| MDL Number | MFCD17677152 |
| Molecular Formula | C7H2ClF6N |
| Molecular Weight | 249.5409 |
| SMILES | FC(C1=C(C(F)(F)F)N=C(Cl)C=C1)(F)F |
| Synonyms | 6-chloro-2,3-bis(trifluoromethyl)pyridine,
6-chloro-2,3-bis-trifluoromethyl-pyridine,
153617-04-0,
ZINC71792915,
AKOS017344231,
2,3-Bis(trifluoromethyl)-6-chloropyridine,
|
| Complexity | 225 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 248.978g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 249.54g/mol |
| Monoisotopic Mass | 248.978g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
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Certificate of Analysis
Lot Number