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CS-W001157 4
Total: USD 88.00

8-Bromo-3-(trifluoromethyl)quinoline

  • CAS No. 917251-86-6

  • Cat. No. CS-0330325
  • Purity≥95%
  • MDL No.MFCD15144568

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

8-Bromo-3-(trifluoromethyl)quinoline|CS-0330325

Structure of 917251-86-6

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General Information

  • CAS No. 917251-86-6
  • Cat. No. CS-0330325
  • Purity ≥95%
  • MDL No. MFCD15144568
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₅BrF₃N
  • Molecular Weight 276.06
  • Synonym(s) None
  • SMILES C1=CC2=CC(=CN=C2C(=C1)Br)C(F)(F)F

Synthesis

  • Route1

    References

    • US2007/27160 A1, ; Page/Page column 53 ; US 20070027160 A1
  • Route2
    • 3-(Trifluoromethyl)quinoline|CS-0217380
      25199-76-2
    • ~0%
    • In-stock
      8-Bromo-3-(trifluoromethyl)quinoline|CS-0330325
      917251-86-6
    • 5-Bromo-3-(trifluoromethyl)quinoline|CS-0456829
      1239462-41-9

    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
  • Route3
    • In-stock
      8-Bromo-3-iodoquinoline|CS-0368709
      917251-85-5
    • null|null
      10112-11-5
    • ~32%
    • In-stock
      8-Bromo-3-(trifluoromethyl)quinoline|CS-0330325
      917251-86-6

    References

    • Childers, Wayne E.; Havran, Lisa M.; Asselin, Magda; Bicksler, James J.; Chong, Dan C.; Grosu, George T.; Shen, Zhongqi; Abou-Gharbia, Magid A.; Bach, Alvin C.; Harrison, Boyd L.; Kagan, Natasha; Kleintop, Teresa; Magolda, Ronald; Marathias, Vasilios; Robichaud, Albert J.; Sabb, Annmarie L.; Zhang, Mei-Yi; Andree, Terrance H.; Aschmies, Susan H.; Beyer, Chad; Comery, Thomas A.; Day, Mark; Grauer, Steven M.; Hughes, Zoe A.; Rosenzweig-Lipson, Sharon; Platt, Brian; Pulicicchio, Claudine; Smith, Deborah E.; Sukoff-Rizzo, Stacy J.; Sullivan, Kelly M.; Adedoyin, Adedayo; Huselton, Christine; Hirst, Warren D. Journal of Medicinal Chemistry, 2010 , vol. 53, # 10 p. 4066 - 4084

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-H320-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   4.0161
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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