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CS-W001157 4
Total: USD 88.00

2-(4-Nitrophenyl)quinoline-4-carboxylic acid

  • CAS No. 70097-13-1

  • Cat. No. CS-0364642
  • Molecule weight294.26
  • Purity95+%
  • MDL No.None

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

2-(4-Nitrophenyl)quinoline-4-carboxylic acid|CS-0364642

Structure of 70097-13-1

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General Information

  • CAS No. 70097-13-1
  • Cat. No. CS-0364642
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₁₀N₂O₄
  • Molecular Weight 294.26
  • Synonym(s) 2-(4-NITRO-PHENYL)-QUINOLINE-4-CARBOXYLIC ACID
  • SMILES C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)O

Synthesis

  • Route1

    References

    • Sommerauer, Michael; Rager, Christine; Hanack, Michael Journal of the American Chemical Society, 1996 , vol. 118, # 42 p. 10085 - 10093
  • Route2
    • null|null
      70097-11-9
    • ~75%
    • 2-(4-Nitrophenyl)quinoline-4-carboxylic acid|CS-0364642
      70097-13-1

    References

    • Belen'kaya, R. S.; Boreko, E. I.; Zemtsova, M. N.; Kalinina, M. I.; Timofeeva, M. M.; et al. Pharmaceutical Chemistry Journal, 1981 , vol. 15, # 3 p. 171 - 176 Khimiko-Farmatsevticheskii Zhurnal, 1981 , vol. 15, # 3 p. 29 - 35
  • Route3
    • In-stock
      4-Nitrobenzaldehyde|CS-W007577
      555-16-8
    • Pyruvic acid, ≥97%|CS-1268663
      127-17-3
    • null|null
      74497-02-2
    • ~67%
    • 2-(4-Nitrophenyl)quinoline-4-carboxylic acid|CS-0364642
      70097-13-1

    References

    • Wang, Li-Min; Hu, Liang; Chen, Hong-Juan; Sui, Yuan-Yuan; Shen, Wei Journal of Fluorine Chemistry, 2009 , vol. 130, # 4 p. 406 - 409

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   93.33
  • LogP   3.5082
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   3

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