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CS-W001157 4
Total: USD 88.00

1-(4-Nitrophenyl)adamantane

  • CAS No. 1459-49-0

  • Cat. No. CS-0314261
  • Purity≥98%
  • MDL No.None

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

1-(4-Nitrophenyl)adamantane|CS-0314261

Structure of 1459-49-0

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General Information

  • CAS No. 1459-49-0
  • Cat. No. CS-0314261
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₁₉NO₂
  • Molecular Weight 257.33
  • Synonym(s) p-(Adamantyl-1)nitrobenzene
  • SMILES C1=C(C=CC(=C1)[N+](=O)[O-])C23CC4CC(CC(C4)C2)C3

Synthesis

  • Route1
    • 1-Phenyladamantane|CS-W014994
      780-68-7
    • ~52%
    • 1-(4-Nitrophenyl)adamantane|CS-0314261
      1459-49-0

    References

    • Moiseev, I. K.; Klimochkin, Yu. N.; Zemtsova, M. N.; Trakhtenberg, P. L. Journal of Organic Chemistry USSR (English Translation), 1984 , vol. 20, p. 1307 - 1309 Zhurnal Organicheskoi Khimii, 1984 , vol. 20, # 7 p. 1435 - 1438
  • Route2

    References

    • Fukaminato, Tuyoshi; Umemoto, Tohru; Iwata, Yasuhide; Yokojima, Satoshi; Yoneyama, Mitsuru; Nakamura, Shinichiro; Irie, Masahiro Journal of the American Chemical Society, 2007 , vol. 129, # 18 p. 5932 - 5938
  • Route3
    • null|null
      71-43-2
    • ~%
    • 1-(4-Nitrophenyl)adamantane|CS-0314261
      1459-49-0

    References

    • Fukaminato, Tuyoshi; Umemoto, Tohru; Iwata, Yasuhide; Yokojima, Satoshi; Yoneyama, Mitsuru; Nakamura, Shinichiro; Irie, Masahiro Journal of the American Chemical Society, 2007 , vol. 129, # 18 p. 5932 - 5938

Safety Information

Download SDS
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   43.14
  • LogP   4.0626
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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