2-Methyl-2-propanyl 6-(benzyloxy)-3-(2-cyano-2-propanyl)-1H-indole-1-carboxylate
[CAS# 629662-38-0]

Identification

• Name: 2-Methyl-2-propanyl 6-(benzyloxy)-3-(2-cyano-2-propanyl)-1H-indole-1-carboxylate
• Synonyms: 1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-6-(phenylmethoxy)-, 1,1-dimethylethyl ester; 1H-Indole-1-carboxylic acid,3-(1-cyano-1-methylethyl)-6-(phenylmethoxy)-,1-(1,1-dimethylethyl)ester
• Molecular Formula: C₂₄H₂₆N₂O₃
• Molecular Weight: 390.47
• CAS Registry Number: 629662-38-0
• SMILES: CC(C)(C)OC(=O)n1cc(c2c1cc(cc2)OCc3ccccc3)C(C)(C)C#N
• InChI: 1S/C24H26N2O3/c1-23(2,3)29-22(27)26-14-20(24(4,5)16-25)19-12-11-18(13-21(19)26)28-15-17-9-7-6-8-10-17/h6-14H,15H2,1-5H3
• InChIKey: AGVUNFICGZABOM-UHFFFAOYSA-N

Properties

• Density: 1.092g/cm³ (Cal.)
• Boiling point: 545.717°C at 760 mmHg (Cal.)
• Flash point: 283.84°C (Cal.)
• Refractive index: 1.557 (Cal.)