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CS-W001157 4
Total: USD 88.00

1,3-Bis[3,5-bis(trifluoromethyl)phenyl]urea

  • CAS No. 3824-74-6

  • Cat. No. CS-0098604
  • Purity≥98%
  • MDL No.MFCD00018048

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

1,3-Bis[3,5-bis(trifluoromethyl)phenyl]urea|CS-0098604

Structure of 3824-74-6

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General Information

  • CAS No. 3824-74-6
  • Cat. No. CS-0098604
  • Purity ≥98%
  • MDL No. MFCD00018048
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₈F₁₂N₂O
  • Molecular Weight 484.24
  • Synonym(s) None
  • SMILES O=C(NC=1C=C(C=C(C1)C(F)(F)F)C(F)(F)F)NC=2C=C(C=C(C2)C(F)(F)F)C(F)(F)F

Synthesis

  • Route1
    • null|null
      16588-74-2
    • In-stock
      3,5-Di(trifluoromethyl)aniline|CS-W009500
      328-74-5
    • ~78%
    • In-stock
      1,3-Bis[3,5-bis(trifluoromethyl)phenyl]urea|CS-0098604
      3824-74-6

    References

    • Denoyelle, Severine; Chen, Ting; Chen, Limo; Wang, Yibo; Klosi, Edvin; Halperin, Jose A.; Aktas, Bertal H.; Chorev, Michael Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 1 p. 402 - 409
  • Route2
    • In-stock
      3,5-Di(trifluoromethyl)aniline|CS-W009500
      328-74-5
    • null|null
      530-62-1
    • ~69%
    • In-stock
      1,3-Bis[3,5-bis(trifluoromethyl)phenyl]urea|CS-0098604
      3824-74-6

    References

    • Maher, Declan J.; Connon, Stephen J. Tetrahedron Letters, 2004 , vol. 45, # 6 p. 1301 - 1305
  • Route3
    • In-stock
      3,5-Di(trifluoromethyl)aniline|CS-W009500
      328-74-5
    • null|null
      1548-13-6
    • ~7%
    • In-stock
      1,3-Bis[3,5-bis(trifluoromethyl)phenyl]urea|CS-0098604
      3824-74-6

    References

    • Busschaert, Nathalie; Kirby, Isabelle L.; Young, Sarah; Coles, Simon J.; Horton, Peter N.; Light, Mark E.; Gale, Philip A. Angewandte Chemie - International Edition, 2012 , vol. 51, # 18 p. 4426 - 4430

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   41.13
  • LogP   7.4058
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   2

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