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CS-W001157 4
Total: USD 88.00

[3-(trifluoromethyl)phenyl]urea

  • CAS No. 13114-87-9

  • Cat. No. CS-0037972
  • Purity≥98%
  • MDL No.None

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

[3-(trifluoromethyl)phenyl]urea|CS-0037972

Structure of 13114-87-9

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General Information

  • CAS No. 13114-87-9
  • Cat. No. CS-0037972
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇F₃N₂O
  • Molecular Weight 204.15
  • Synonym(s) Didemethylfluometuron
  • SMILES C1=CC(=CC(=C1)NC(=N)O)C(F)(F)F

Synthesis

  • Route1
    • null|null
      917-61-3
    • null|null
      98-16-8
    • ~85%
    • In-stock
      [3-(trifluoromethyl)phenyl]urea|CS-0037972
      13114-87-9

    References

    • ARGENTA DISCOVERY 2009 LIMITED; EDWARDS, Christine; KULAGOWSKI, Janusz; FINCH, Harry Patent: WO2010/34996 A1, 2010 ; Location in patent: Page/Page column 14 ; WO 2010/034996 A1
  • Route2
    • null|null
      75-13-8
    • null|null
      98-16-8
    • ~66%
    • In-stock
      [3-(trifluoromethyl)phenyl]urea|CS-0037972
      13114-87-9

    References

    • Kirpichev, V. P.; Karachinskii, S. V.; Dragalov, V. V.; Peshkova, O. Yu. Journal of Organic Chemistry USSR (English Translation), 1992 , vol. 28, # 10 p. 1651 - 1653 Zhurnal Organicheskoi Khimii, 1992 , vol. 28, # 10 p. 2063 - 2065
  • Route3
    • null|null
      590-28-3
    • null|null
      98-16-8
    • ~%
    • In-stock
      [3-(trifluoromethyl)phenyl]urea|CS-0037972
      13114-87-9

    References

    • Journal of the Chemical Society, Perkin Transactions 2, , # 11 p. 2226 - 2229

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   56.11
  • LogP   2.61007
  • H_Acceptors   1
  • H_Donors   3
  • Rotatable_Bonds   1

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