(5-Cyano-1H-Indol-3-Yl)Acetic Acid
[CAS# 202124-89-8]

Identification

• Name: (5-Cyano-1H-Indol-3-Yl)Acetic Acid
• Synonyms: 1H-INDOLE-3-ACETICACID, 5-CYANO-; 1H-Indole-3-aceticacid,5-cyano-; 2-(5-cyano-1H-indol-3-yl)acetic acid
• Molecular Formula: C₁₁H₈N₂O₂
• Molecular Weight: 200.19
• CAS Registry Number: 202124-89-8
• SMILES: N#Cc1cc2c(cc1)ncc2CC(=O)O
• InChI: 1S/C11H8N2O2/c12-5-7-1-2-10-9(3-7)8(6-13-10)4-11(14)15/h1-3,6,13H,4H2,(H,14,15)
• InChIKey: ZOZRQPFDLUFZPO-UHFFFAOYSA-N

Properties

• Density: 1.419g/cm³ (Cal.)
• Boiling point: 498.879°C at 760 mmHg (Cal.)
• Flash point: 255.513°C (Cal.)
• Refractive index: 1.687 (Cal.)