(5-Propyl-1H-Indol-3-Yl)Acetic Acid
[CAS# 136281-78-2]

Identification

• Name: (5-Propyl-1H-Indol-3-Yl)Acetic Acid
• Synonyms: 1H-Indole-3-aceticacid,5-propyl-; 2-(5-propyl-1H-indol-3-yl)acetic acid
• Molecular Formula: C₁₃H₁₅NO₂
• Molecular Weight: 217.26
• CAS Registry Number: 136281-78-2
• SMILES: CCCC1=CC2=C(C=C1)NC=C2CC(=O)O
• InChI: 1S/C13H15NO2/c1-2-3-9-4-5-12-11(6-9)10(8-14-12)7-13(15)16/h4-6,8,14H,2-3,7H2,1H3,(H,15,16)
• InChIKey: QOIMIIUSWMALMN-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 432.4±30.0°C at 760 mmHg (Cal.)
• Flash point: 215.3±24.6°C (Cal.)
• Refractive index: 1.633 (Cal.)