(1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-5-[2-(4-morpholinyl)ethoxy]-1H-indol-2-yl)boronic acid
[CAS# 913388-60-0]

Identification

• Name: (1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-5-[2-(4-morpholinyl)ethoxy]-1H-indol-2-yl)boronic acid
• Synonyms: 1H-Indole-1-carboxylic acid, 2-borono-5-[2-(4-morpholinyl)ethoxy]-, 1-(1,1-dimethylethyl) ester; 1H-Indole-1-carboxylic acid,2-borono-5-[2-(4-morpholinyl)ethoxy]-,1-(1,1-dimethylethyl)ester
• Molecular Formula: C₁₉H₂₇BN₂O₆
• Molecular Weight: 390.24
• CAS Registry Number: 913388-60-0
• SMILES: B(c1cc2cc(ccc2n1C(=O)OC(C)(C)C)OCCN3CCOCC3)(O)O
• InChI: 1S/C19H27BN2O6/c1-19(2,3)28-18(23)22-16-5-4-15(12-14(16)13-17(22)20(24)25)27-11-8-21-6-9-26-10-7-21/h4-5,12-13,24-25H,6-11H2,1-3H3
• InChIKey: IDHKZEMHMSUJCQ-UHFFFAOYSA-N

Properties

• Density: 1.245g/cm³ (Cal.)
• Boiling point: 589.846°C at 760 mmHg (Cal.)
• Flash point: 310.528°C (Cal.)
• Refractive index: 1.563 (Cal.)