1H-Indole-3-carboxylic acid,6-bromo-ethyl ester

• Catalog Number: ACM103858555
• Product Name: 1H-Indole-3-carboxylic acid,6-bromo-ethyl ester
• CAS: 103858-55-5
• Category: Heterocyclic Organic Compound
• Description: Ethyl 6-bromo-1H-indole-3-carboxylate is a marine derived natural products found in Pleroma menoui.
• Synonyms: 6-Bromoindole-3-carboxylic acid ethyl ester
• IUPAC Name: Ethyl 6-bromo-1H-indole-3-carboxylate
• Molecular Weight: 268.11
• Canonical SMILES: CCOC(=O)C1=CNC2=C1C=CC(=C2)Br
• InChI: InChI=1S/C11H10BrNO2/c1-2-15-11(14)9-6-13-10-5-7(12)3-4-8(9)10/h3-6,13H,2H2,1H3
• InChI Key: GBTDSENHTMLWAI-UHFFFAOYSA-N
• Boiling Point: 394.7±22.0 °C
• Melting Point: 134-137 °C
• Density: 1.554±0.06 g/cm³
• Complexity: 247
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 0
• Exact Mass: 266.98949
• Heavy Atom Count: 15
• Monoisotopic Mass: 266.98949
• Physical State: Powder
• Storage Conditions: Powder: -20°C for 3 years In solvent: -80°C for 2 years
• Topological Polar Surface Area: 42.1 Ų