2-Methoxycarbonylbenzothiophene-5-boronic acid pinacol ester
[CAS# 690632-26-9]

Identification

• Name: 2-Methoxycarbonylbenzothiophene-5-boronic acid pinacol ester
• Synonyms: Methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[b]thiophene-2-carboxylate; Methyl5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzothiophene-2-carboxylate; Methyl5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-benzothiophene-2-carboxylate
• Molecular Formula: C₁₆H₁₉BO₄S
• Molecular Weight: 318.20
• CAS Registry Number: 690632-26-9
• SMILES: O=C(OC)c2sc1ccc(cc1c2)B3OC(C)(C)C(O3)(C)C
• InChI: 1S/C16H19BO4S/c1-15(2)16(3,4)21-17(20-15)11-6-7-12-10(8-11)9-13(22-12)14(18)19-5/h6-9H,1-5H3
• InChIKey: XCYQFYKHKQJYJP-UHFFFAOYSA-N

Properties

• Density: 1.205g/cm³ (Cal.)
• Boiling point: 440.65°C at 760 mmHg (Cal.)
• Flash point: 220.297°C (Cal.)
• Refractive index: 1.567 (Cal.)