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B8875 Sigma-Aldrich

1-Benzylindole-3-carboxylic acid

  • CAS Number 27018-76-4

  • Empirical Formula (Hill Notation) C16H13NO2

  • Molecular Weight 251.28

  •  MDL number MFCD00057094

  •  PubChem Substance ID 57653965

  •  NACRES NA.22

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Properties

Related Categories Building Blocks, C13 to C27, Chemical Synthesis, Heterocyclic Building Blocks, Indoles More...
Quality Level   100
storage temp.   −20°C
SMILES string   OC(=O)c1cn(Cc2ccccc2)c3ccccc13
InChI   1S/C16H13NO2/c18-16(19)14-11-17(10-12-6-2-1-3-7-12)15-9-5-4-8-13(14)15/h1-9,11H,10H2,(H,18,19)
InChI key   LVYDDRHDOKXFMW-UHFFFAOYSA-N

Description

Application

Reactant for preparation of:
• Indoleacetic acid analogs as differentiation-inducing and antiproliferative agents for human myeloblastoma cells
• Indole-carboxamide derivatives as inhibitors of lipid peroxidation and superoxide anion formation
• Indole carboxamides as hyaluronidase inhibitors
• Fuconojirimycin derivatives as inhibitors of α-fucosidases
• Indole-2 and 3-carboxamides as selective cyclooxygenase-2 inhibitors
• Indole amides as antihistaminic agents

Packaging

1 g in poly bottle

Safety & Documentation

Safety Information

RIDADR 
NONH for all modes of transport
WGK Germany 
WGK 3
Flash Point(F) 
Not applicable
Flash Point(C) 
Not applicable

Documents

Certificate of Analysis (COA)

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Certificate of Origin (COO)

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