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Cat. No. Size / Unit Price Qty
CS-W001157 4
Total: USD 88.00

3-(4-Nitrophenyl)adamantane-1-carboxylic acid

  • CAS No. 7123-76-4

  • Cat. No. CS-0466248
  • Purity≥98%
  • MDL No.MFCD00188065

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

3-(4-Nitrophenyl)adamantane-1-carboxylic acid|CS-0466248

Structure of 7123-76-4

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General Information

  • CAS No. 7123-76-4
  • Cat. No. CS-0466248
  • Purity ≥98%
  • MDL No. MFCD00188065
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₁₉NO₄
  • Molecular Weight 301.34
  • Synonym(s) 3-(4-nitrophenyl)tricyclo[3.3.1.1~3,7~]decane-1-carboxylic acid
  • SMILES C1=C(C=CC(=C1)[N+](=O)[O-])C23CC4CC(C2)CC(C4)(C3)C(=O)O

Synthesis

  • Route1
    • 1-(4-Nitrophenyl)adamantane|CS-0314261
      1459-49-0
    • ~%
    • 3-(4-Nitrophenyl)adamantane-1-carboxylic acid|CS-0466248
      7123-76-4

    References

    • Zhurnal Organicheskoi Khimii, , vol. 2, p. 640 - 643,640 - 643
  • Route2
    • 1-Phenyladamantane|CS-W014994
      780-68-7
    • ~%
    • 3-(4-Nitrophenyl)adamantane-1-carboxylic acid|CS-0466248
      7123-76-4

    References

    • Zhurnal Organicheskoi Khimii, , vol. 2, p. 640 - 643,640 - 643
  • Route3
    • null|null
      64-18-6
    • null|null
      7163-93-1
    • ~%
    • 3-(4-Nitrophenyl)adamantane-1-carboxylic acid|CS-0466248
      7123-76-4

    References

    • Zhurnal Organicheskoi Khimii, , vol. 2, p. 640 - 643,640 - 643

Safety Information

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

Quality Control

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Computational Chemistry Data

  • TPSA   80.44
  • LogP   3.5174
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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