(5-[3-(1,3-Dioxolan-2-yl)propyl]-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-1H-indol-2-yl)boronic acid
[CAS# 906000-55-3]

Identification

• Name: (5-[3-(1,3-Dioxolan-2-yl)propyl]-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-1H-indol-2-yl)boronic acid
• Synonyms: 1H-Indole-1-carboxylic acid, 2-borono-5-[3-(1,3-dioxolan-2-yl)propyl]-, 1-(1,1-dimethylethyl) ester; 1H-Indole-1-carboxylic acid,2-borono-5-[3-(1,3-dioxolan-2-yl)propyl]-,1-(1,1-dimethylethyl)ester
• Molecular Formula: C₁₉H₂₆BNO₆
• Molecular Weight: 375.22
• CAS Registry Number: 906000-55-3
• SMILES: B(c1cc2cc(ccc2n1C(=O)OC(C)(C)C)CCCC3OCCO3)(O)O
• InChI: 1S/C19H26BNO6/c1-19(2,3)27-18(22)21-15-8-7-13(5-4-6-17-25-9-10-26-17)11-14(15)12-16(21)20(23)24/h7-8,11-12,17,23-24H,4-6,9-10H2,1-3H3
• InChIKey: DMFMWPGLVDKTPT-UHFFFAOYSA-N

Properties

• Density: 1.24g/cm³ (Cal.)
• Boiling point: 557.392°C at 760 mmHg (Cal.)
• Flash point: 290.901°C (Cal.)
• Refractive index: 1.56 (Cal.)