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CS-W001157 4
Total: USD 88.00

3-(Trifluoromethyl)quinoline

  • CAS No. 25199-76-2

  • Cat. No. CS-0217380
  • Purity≥97%
  • MDL No.None

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

3-(Trifluoromethyl)quinoline|CS-0217380

Structure of 25199-76-2

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General Information

  • CAS No. 25199-76-2
  • Cat. No. CS-0217380
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₆F₃N
  • Molecular Weight 197.16
  • Synonym(s) Quinoline,3-(trifluoromethyl)
  • SMILES C1=CC2=CC(=CN=C2C=C1)C(F)(F)F

Synthesis

  • Route1

    References

    • ELAN PHARMACEUTICALS, INC.; SHAM, Hing, L.; KONRADI, Andrei, W.; HOM, Roy, K.; PROBST, Gary, D.; BOWERS, Simeon; TRUONG, Anh; NEITZ, R., Jeffrey; SEALY, Jennifer; TOTH, Gergely Patent: WO2010/91310 A1, 2010 ; Location in patent: Page/Page column 148 ; WO 2010/091310 A1
  • Route2

    References

    • Ye, Yingda; Kuenzi, Stefan A.; Sanford, Melanie S. Organic Letters, 2012 , vol. 14, # 19 p. 4979 - 4981,3 Title/Abstract Full Text Show Details Ye, Yingda; Kuenzi, Stefan A.; Sanford, Melanie S. Organic Letters, 2012 , vol. 14, # 19 p. 4979 - 4981
  • Route3

    References

    • Jiang, Xueliang; Chu, Lingling; Qing, Feng-Ling Journal of Organic Chemistry, 2012 , vol. 77, # 3 p. 1251 - 1257

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   12.89
  • LogP   3.2536
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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