Ethyl 3-indoleacetate

• Catalog Number: ACM778825
• Product Name: Ethyl 3-indoleacetate
• CAS: 778-82-5
• Category: Heterocyclic Organic Compound
• Synonyms: Ethyl 1H-indol-3-ylacetate
• IUPAC Name: Ethyl 2-(1H-indol-3-yl)acetate
• Molecular Weight: 203.24
• Molecular Formula: C12H13NO2
• Canonical SMILES: CCOC(=O)CC1=CNC2=CC=CC=C21
• InChI: InChI=1S/C12H13NO2/c1-2-15-12(14)7-9-8-13-11-6-4-3-5-10(9)11/h3-6,8,13H,2,7H2,1H3
• InChI Key: HUDBDWIQSIGUDI-UHFFFAOYSA-N
• Boiling Point: 164-166 °C/1 mmHg(lit.)
• Melting Point: 44-45 °C(lit.)
• Flash Point: >230 °F
• Density: 1.1255 g/cm³
• Solubility: Soluble in methanol
• Appearance: White crystalline powder
• Storage: Sealed in dry, room temperature
• Complexity: 230
• Exact Mass: 203.094628657
• Monoisotopic Mass: 203.094628657
• pKa: 16.70±0.30(Predicted)
• Refractive Index: 1.5260
• Topological Polar Surface Area: 42.1 Ų