(5-[(Dimethylamino)methyl]-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-1H-indol-2-yl)boronic acid
[CAS# 913388-74-6]

Identification

• Name: (5-[(Dimethylamino)methyl]-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-1H-indol-2-yl)boronic acid
• Synonyms: 1H-Indole-1-carboxylic acid, 2-borono-5-[(dimethylamino)methyl]-, 1-(1,1-dimethylethyl) ester; 1H-Indole-1-carboxylic acid,2-borono-5-[(dimethylamino)methyl]-,1-(1,1-dimethylethyl)ester
• Molecular Formula: C₁₆H₂₃BN₂O₄
• Molecular Weight: 318.18
• CAS Registry Number: 913388-74-6
• SMILES: B(c1cc2cc(ccc2n1C(=O)OC(C)(C)C)CN(C)C)(O)O
• InChI: 1S/C16H23BN2O4/c1-16(2,3)23-15(20)19-13-7-6-11(10-18(4)5)8-12(13)9-14(19)17(21)22/h6-9,21-22H,10H2,1-5H3
• InChIKey: DDFZDMZDMLORBU-UHFFFAOYSA-N

Properties

• Density: 1.14g/cm³ (Cal.)
• Boiling point: 473.847°C at 760 mmHg (Cal.)
• Flash point: 240.374°C (Cal.)
• Refractive index: 1.539 (Cal.)