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CS-W001157 4
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5-Hydroxy-1-naphthonitrile

  • CAS No. 20816-78-8

  • Cat. No. CS-0518721
  • Purity≥98%
  • MDL No.MFCD17012230

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

5-Hydroxy-1-naphthonitrile|CS-0518721

Structure of 20816-78-8

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General Information

  • CAS No. 20816-78-8
  • Cat. No. CS-0518721
  • Purity ≥98%
  • MDL No. MFCD17012230
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₇NO
  • Molecular Weight 169.18
  • Synonym(s) 5-Hydroxynaphthalene-1-carbonitrile
  • SMILES OC1=CC=CC2=C(C#N)C=CC=C12

Synthesis

  • Route1
    • 5-Methoxy-1-naphthonitrile|CS-0511571
      3813-01-2
    • ~77%
    • 5-Hydroxy-1-naphthonitrile|CS-0518721
      20816-78-8

    References

    • Tolbert, Laren M.; Haubrich, Jeanne E. Journal of the American Chemical Society, 1994 , vol. 116, # 23 p. 10593 - 10600
  • Route2

    References

    • Tolbert, Laren M.; Haubrich, Jeanne E. Journal of the American Chemical Society, 1994 , vol. 116, # 23 p. 10593 - 10600
  • Route3
    • null|null
      86-57-7
    • ~%
    • 5-Hydroxy-1-naphthonitrile|CS-0518721
      20816-78-8

    References

    • Tsuno,Y. et al. Bulletin of the Chemical Society of Japan, 1975 , vol. 48, p. 3356 - 3366

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   44.02
  • LogP   2.41708
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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