[1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-5-(1-piperidinylmethyl)-1H-indol-2-yl]boronic acid
[CAS# 913388-56-4]

Identification

• Name: [1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-5-(1-piperidinylmethyl)-1H-indol-2-yl]boronic acid
• Synonyms: 1H-Indole-1-carboxylic acid, 2-borono-5-(1-piperidinylmethyl)-, 1-(1,1-dimethylethyl) ester; 1H-Indole-1-carboxylic acid,2-borono-5-(1-piperidinylmethyl)-,1-(1,1-dimethylethyl)ester
• Molecular Formula: C₁₉H₂₇BN₂O₄
• Molecular Weight: 358.24
• CAS Registry Number: 913388-56-4
• SMILES: B(c1cc2cc(ccc2n1C(=O)OC(C)(C)C)CN3CCCCC3)(O)O
• InChI: 1S/C19H27BN2O4/c1-19(2,3)26-18(23)22-16-8-7-14(13-21-9-5-4-6-10-21)11-15(16)12-17(22)20(24)25/h7-8,11-12,24-25H,4-6,9-10,13H2,1-3H3
• InChIKey: QTYQDVDTPBUKTP-UHFFFAOYSA-N

Properties

• Density: 1.192g/cm³ (Cal.)
• Boiling point: 528.569°C at 760 mmHg (Cal.)
• Flash point: 273.469°C (Cal.)
• Refractive index: 1.573 (Cal.)