IUPAC Name: | 2,5-bis(2,2,2-trifluoroethoxy)benzoic acid |
Description: | An impurity of Flecainide. Flecainide is a class 2C antiarrhythmic drug especially used for the management of supraventricular arrhythmia. |
Molecular Weight: | 318.17 |
Molecular Formula: | C11H8F6O4 |
Canonical SMILES: | C1=CC(=C(C=C1OCC(F)(F)F)C(=O)O)OCC(F)(F)F |
InChI: | InChI=1S/C11H8F6O4/c12-10(13,14)4-20-6-1-2-8(7(3-6)9(18)19)21-5-11(15,16)17/h1-3H,4-5H2,(H,18,19) |
InChI Key: | YPGYLCZBZKRYQJ-UHFFFAOYSA-N |
Boiling Point: | 320.9±42.0 °C (Predicted) |
Melting Point: | 121-124 °C |
Purity: | > 95 % |
Density: | 1.474±0.06 g/cm3 (Predicted) |
Appearance: | White to off-white solid |
MDL: | MFCD00221424 |
LogP: | 3.26700 |
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1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
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