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Methyl 3-iodo-1H-indole-6-carboxylate

  • CAS No. 850374-98-0

  • Cat. No. CS-0069918
  • Purity≥98%
  • MDL No.MFCD06797504

*For research and further manufacturing use only, not for direct human use.

Methyl 3-iodo-1H-indole-6-carboxylate|CS-0069918

Structure of 850374-98-0

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General Information

  • CAS No. 850374-98-0
  • Cat. No. CS-0069918
  • Purity ≥98%
  • MDL No. MFCD06797504
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈INO₂
  • Molecular Weight 301.08
  • Synonym(s) 1H-Indole-6-carboxylic acid, 3-iodo-, methyl ester
  • SMILES O=C(C1=CC2=C(C=C1)C(I)=CN2)OC

Synthesis

  • Route1

    References

    • Mothes, Celine; Lavielle, Solange; Karoyan, Philippe Journal of Organic Chemistry, 2008 , vol. 73, # 17 p. 6706 - 6710

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   42.09
  • LogP   2.5591
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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