[(1-Ethyl-1H-indol-3-yl)sulfanyl]acetic acid
[CAS# 883539-49-9]

Identification

• Name: [(1-Ethyl-1H-indol-3-yl)sulfanyl]acetic acid
• Synonyms: (1-Ethyl-1H-indol-3-ylsulfanyl)-acetic acid; [(1-ethyl-1H-indol-3-yl)thio]acetic acid; 2-((1-ethyl-1H-indol-3-yl)thio)acetic acid
• Molecular Formula: C₁₂H₁₃NO₂S
• Molecular Weight: 235.30
• CAS Registry Number: 883539-49-9
• SMILES: O=C(O)CSc2c1ccccc1n(c2)CC
• InChI: 1S/C12H13NO2S/c1-2-13-7-11(16-8-12(14)15)9-5-3-4-6-10(9)13/h3-7H,2,8H2,1H3,(H,14,15)
• InChIKey: MMJJISRIJIKCGW-UHFFFAOYSA-N

Properties

• Density: 1.253g/cm³ (Cal.)
• Boiling point: 442.822°C at 760 mmHg (Cal.)
• Flash point: 221.611°C (Cal.)
• Refractive index: 1.621 (Cal.)

Safety Data

• Safety Description: IRRITANT