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CS-W001157 4
Total: USD 88.00

2-Methyl-1H-indole-3-carbaldehyde

  • CAS No. 5416-80-8

  • Cat. No. CS-W007520
  • Molecule weight159.19
  • Purity≥98%
  • MDL No.MFCD00012077

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

2-Methyl-1H-indole-3-carbaldehyde|CS-W007520

Structure of 5416-80-8

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General Information

  • CAS No. 5416-80-8
  • Cat. No. CS-W007520
  • Purity ≥98%
  • MDL No. MFCD00012077
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉NO
  • Molecular Weight 159.19
  • Synonym(s) 3-Formyl-2-methylindole
  • SMILES C1=CC=CC2=C1C(=C(C)[NH]2)C=O

Description

Oxidative activation of 2-methylindole-3-carboxaldehyde via N-heterocyclic carbene organocatalysis generates heterocyclic ortho-quinodimethane as a key intermediate.2-Methylindole-3-carboxaldehyde has been used in the preparation of 1-phenylsulfonyl-2-methylindole-3-carboxaldehyde.

Synthesis

  • Route1
    • In-stock
      2-Methylindole|CS-W007556
      95-20-5
    • null|null
      68-12-2
    • ~94%
    • In-stock
      2-Methyl-1H-indole-3-carbaldehyde|CS-W007520
      5416-80-8

    References

    • Moody, Christopher J.; Ward, John G. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1984 , # 12 p. 2895 - 2901
  • Route2
    • null|null
      65283-33-2
    • ~75%
    • In-stock
      2-Methyl-1H-indole-3-carbaldehyde|CS-W007520
      5416-80-8

    References

    • Ranise, Angelo; Lucchesini, Francesco; Caviglia, Matteo; Alfei, Silvana; Spallarossa, Andrea; Caneva, Chiara Tetrahedron, 2013 , vol. 69, # 51 p. 10858 - 10868
  • Route3
    • In-stock
      2-Methylindole|CS-W007556
      95-20-5
    • null|null
      100-61-8
    • ~41%
    • In-stock
      2-Methyl-1H-indole-3-carbaldehyde|CS-W007520
      5416-80-8

    References

    • Li, Lan-Tao; Huang, Juan; Li, Hong-Ying; Wen, Li-Juan; Wang, Peng; Wang, Bin Chemical Communications, 2012 , vol. 48, # 42 p. 5187 - 5189

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

Quality Control

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Computational Chemistry Data

  • TPSA   32.86
  • LogP   2.28882
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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