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CS-W001157 4
Total: USD 88.00

2-(1H-indol-7-yl)acetonitrile

  • CAS No. 82199-98-2

  • Cat. No. CS-0466524
  • Purity≥98%
  • MDL No.MFCD09263867

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

2-(1H-indol-7-yl)acetonitrile|CS-0466524

Structure of 82199-98-2

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General Information

  • CAS No. 82199-98-2
  • Cat. No. CS-0466524
  • Purity ≥98%
  • MDL No. MFCD09263867
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈N₂
  • Molecular Weight 156.18
  • Synonym(s) 7-(Cyanomethyl)indole
  • SMILES C1=CC(=C2C(=C1)C=CN2)CC#N

Synthesis

  • Route1

    References

    • Engler, Thomas A.; Furness, Kelly; Malhotra, Sushant; Diefenbacher, Clive; Clayton, Joshua R. Tetrahedron Letters, 2003 , vol. 44, # 14 p. 2903 - 2905
  • Route2
    • Indole, ≥99%|CS-1268948
      120-72-9
    • null|null
      99749-00-5
    • ~%
    • 2-(1h-Indol-4-yl)acetonitrile|CS-0269018
      30933-66-5
    • 2-(1H-indol-7-yl)acetonitrile|CS-0466524
      82199-98-2

    References

    • Semmelhack, M.F.; Clark, G.R.; Garcia, J.L.; Harrison, J.J.; Thebtaranonth, Y.; et. al Tetrahedron, 1981 , vol. 37, # 23 p. 3957 - 3965

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   39.58
  • LogP   2.23398
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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