5-Bromo-2-(trifluoromethyl)pyridin-4-ol - CAS 1196156-74-7
Catalog: |
BB070902 |
Product Name: |
5-Bromo-2-(trifluoromethyl)pyridin-4-ol |
CAS: |
1196156-74-7 |
Synonyms: |
5-BROMO-2-(TRIFLUOROMETHYL)PYRIDIN-4-OL; 5-bromo-2-(trifluoromethyl)-1H-pyridin-4-one; 5-BROMO-2-(TRIFLUOROMETHYL)-4-HYDROXYPYRIDINE; 5-Bromo-2-(trifluoromethyl)-4-pyridinol |
IUPAC Name: | 5-bromo-2-(trifluoromethyl)-1H-pyridin-4-one |
Molecular Weight: | 241.99 |
Molecular Formula: | C6H3NOF3Br |
Canonical SMILES: | C1=C(NC=C(C1=O)Br)C(F)(F)F |
InChI: | InChI=1S/C6H3BrF3NO/c7-3-2-11-5(1-4(3)12)6(8,9)10/h1-2H,(H,11,12) |
InChI Key: | WYYQXVGBZRSUGC-UHFFFAOYSA-N |
Complexity: | 279 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 240.93501 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 240.93501 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 29.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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