6-Bromo-3-fluoro-2-(trifluoromethyl)pyridine - CAS 1227578-46-2
Catalog: |
BB072211 |
Product Name: |
6-Bromo-3-fluoro-2-(trifluoromethyl)pyridine |
CAS: |
1227578-46-2 |
Synonyms: |
6-bromo-3-fluoro-2-(trifluoromethyl)pyridine; 6-Bromo-3-fluoro-2-trifluoromethyl-pyridine |
IUPAC Name: | 6-bromo-3-fluoro-2-(trifluoromethyl)pyridine |
Molecular Weight: | 243.98 |
Molecular Formula: | C6H2BrF4N |
Canonical SMILES: | C1=CC(=NC(=C1F)C(F)(F)F)Br |
InChI: | InChI=1S/C6H2BrF4N/c7-4-2-1-3(8)5(12-4)6(9,10)11/h1-2H |
InChI Key: | NEMDVTHUXJKSDX-UHFFFAOYSA-N |
Complexity: | 160 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 242.93067 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 242.93067 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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