3-(2-Methyl-1H-Indol-1-Yl)Propanoic Acid
[CAS# 42951-33-7]

Identification

• Name: 3-(2-Methyl-1H-Indol-1-Yl)Propanoic Acid
• Synonyms: 3-(2-Methyl-indol-1-yl)-propionic acid; 3-(2-methylindolyl)propanoic acid; AP-124/43383562
• Molecular Formula: C₁₂H₁₃NO₂
• Molecular Weight: 203.24
• CAS Registry Number: 42951-33-7
• SMILES: CC1=CC2=CC=CC=C2N1CCC(=O)O
• InChI: 1S/C12H13NO2/c1-9-8-10-4-2-3-5-11(10)13(9)7-6-12(14)15/h2-5,8H,6-7H2,1H3,(H,14,15)
• InChIKey: OJDOEXJZNZKRBK-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 408.9±28.0°C at 760 mmHg (Cal.)
• Flash point: 201.1±24.0°C (Cal.)

Safety Data

• Safety Description: IRRITANT