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CS-W001157 4
Total: USD 88.00

[4-(trifluoromethyl)phenyl]thiourea

  • CAS No. 1736-72-7

  • Cat. No. CS-0216572
  • Molecule weight220.21
  • Purity≥97%
  • MDL No.MFCD00041189

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

[4-(trifluoromethyl)phenyl]thiourea|CS-0216572

Structure of 1736-72-7

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General Information

  • CAS No. 1736-72-7
  • Cat. No. CS-0216572
  • Purity ≥97%
  • MDL No. MFCD00041189
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇F₃N₂S
  • Molecular Weight 220.21
  • Synonym(s) 1-[4-(TRIFLUOROMETHYL)PHENYL]-2-THIOUREA
  • SMILES NC(NC1=CC=C(C(F)(F)F)C=C1)=S

Synthesis

  • Route1
    • 4-(Trifluoromethyl)aniline Leflunomide Impurity|CS-0229655
      455-14-1
    • null|null
      333-20-0
    • ~99%
    • In-stock
      [4-(trifluoromethyl)phenyl]thiourea|CS-0216572
      1736-72-7

    References

    • NOVO NORDISK A/S Patent: WO2004/2480 A1, 2004 ; Location in patent: Page/Page column 150 ; WO 2004/002480 A1
  • Route2

    References

    • WO2007/5785 A1, ; Page/Page column 29-30 ;
  • Route3
    • 4-(Trifluoromethyl)aniline Leflunomide Impurity|CS-0229655
      455-14-1
    • null|null
      1147550-11-5
    • ~12%
    • In-stock
      [4-(trifluoromethyl)phenyl]thiourea|CS-0216572
      1736-72-7

    References

    • THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY; AUCKLAND UNISERVICES LIMITED Patent: WO2009/114552 A1, 2009 ; Location in patent: Page/Page column 149 ;

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-H317
Precautionary Statements : P260-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   38.05
  • LogP   2.3609
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   1

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