2-Methyl-2-propanyl 6-[benzyl(methyl)amino]-3-(2-cyano-2-propanyl)-1H-indole-1-carboxylate
[CAS# 629662-57-3]

Identification

• Name: 2-Methyl-2-propanyl 6-[benzyl(methyl)amino]-3-(2-cyano-2-propanyl)-1H-indole-1-carboxylate
• Synonyms: 1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-6-[methyl(phenylmethyl)amino]-, 1,1-dimethylethyl ester; 1H-Indole-1-carboxylic acid,3-(1-cyano-1-methylethyl)-6-[methyl(phenylmethyl)amino]-,1-(1,1-dimethylethyl)ester
• Molecular Formula: C₂₅H₂₉N₃O₂
• Molecular Weight: 403.52
• CAS Registry Number: 629662-57-3
• SMILES: CC(C)(C)OC(=O)n1cc(c2c1cc(cc2)N(C)Cc3ccccc3)C(C)(C)C#N
• InChI: 1S/C25H29N3O2/c1-24(2,3)30-23(29)28-16-21(25(4,5)17-26)20-13-12-19(14-22(20)28)27(6)15-18-10-8-7-9-11-18/h7-14,16H,15H2,1-6H3
• InChIKey: QVTKDIXKZMREDD-UHFFFAOYSA-N

Properties

• Density: 1.071g/cm³ (Cal.)
• Boiling point: 565.085°C at 760 mmHg (Cal.)
• Flash point: 295.553°C (Cal.)
• Refractive index: 1.561 (Cal.)