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| IUPAC Name: | [3,5-bis(trifluoromethyl)phenyl]boronic acid |
| Description: | Reactant involved in the synthesis of: Methylene-arylbutenones via carbonylative arylation of allenols; 4-aminoquinoline analogs via Ullman / Suzuki / Negishi coupling; Primary amino acid derivatives with anticonvulsant activity; Alkyl arylcarbamates via Cu-catalyzed coupling with potassium cyanate; Aryl-substituted succinimides and cyclic ketones by asymmetric conjugate addition; Axially chiral dicarboxylic acids for asymmetric Mannich-type reactions. |
| Molecular Weight: | 257.93 |
| Molecular Formula: | C8H5F6O2B |
| Canonical SMILES: | B(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)(O)O |
| InChI: | InChI=1S/C8H5BF6O2/c10-7(11,12)4-1-5(8(13,14)15)3-6(2-4)9(16)17/h1-3,16-17H |
| InChI Key: | BPTABBGLHGBJQR-UHFFFAOYSA-N |
| Boiling Point: | 128.685 ℃ at 760 mmHg |
| Melting Point: | 217-220 ℃ (lit.) |
| Flash Point: | Not applicable |
| Purity: | ≥ 95 % |
| Density: | 1.128 g/cm3 |
| MDL: | MFCD00051850 |
| LogP: | 1.40400 |
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