2-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
[CAS# 867256-77-7]

Identification

• Name: 2-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
• Synonyms: 2-fluoro-4-(4,4,5,5-tetramethyl(1,3,2-dioxaborolan-2-yl))benzoic acid; 2-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid; 4-Carboxy-3-fluorobenzeneboronic acid, pinacol ester
• Molecular Formula: C₁₃H₁₆BFO₄
• Molecular Weight: 266.07
• CAS Registry Number: 867256-77-7
• SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C=C2)C(=O)O)F
• InChI: 1S/C13H16BFO4/c1-12(2)13(3,4)19-14(18-12)8-5-6-9(11(16)17)10(15)7-8/h5-7H,1-4H3,(H,16,17)
• InChIKey: BZWWFDHWZHGLFH-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Melting point: 289-295°C (Expl.)
• Boiling point: 377.6±32.0°C at 760 mmHg (Cal.)
• Flash point: 182.2±25.1°C (Cal.)
• Refractive index: 1.51 (Cal.)

Safety Data

• Safety Description: Irritant/Keep Cold