Methyl (5-cyano-1-methyl-1H-indol-3-yl)acetate
[CAS# 796856-92-3]

Identification

• Name: Methyl (5-cyano-1-methyl-1H-indol-3-yl)acetate
• Synonyms: methyl 2-(5-cyano-1-methyl-1H-indol-3-yl)acetate
• Molecular Formula: C₁₃H₁₂N₂O₂
• Molecular Weight: 228.25
• CAS Registry Number: 796856-92-3
• SMILES: Cn1cc(c2c1ccc(c2)C#N)CC(=O)OC
• InChI: 1S/C13H12N2O2/c1-15-8-10(6-13(16)17-2)11-5-9(7-14)3-4-12(11)15/h3-5,8H,6H2,1-2H3
• InChIKey: IHLKIGUVKRCGOZ-UHFFFAOYSA-N

Properties

• Density: 1.174g/cm³ (Cal.)
• Boiling point: 405.136°C at 760 mmHg (Cal.)
• Flash point: 198.82°C (Cal.)
• Refractive index: 1.584 (Cal.)