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CS-W001157 4
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1-(2-Fluorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid

  • CAS No. 887035-85-0

  • Cat. No. CS-0070604
  • Purity≥98%
  • MDL No.MFCD07397775

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

1-(2-Fluorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid|CS-0070604

Structure of 887035-85-0

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General Information

  • CAS No. 887035-85-0
  • Cat. No. CS-0070604
  • Purity ≥98%
  • MDL No. MFCD07397775
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈FN₃O₂
  • Molecular Weight 221.19
  • Synonym(s) 1-(2-Fluoro-phenyl)-5-methyl-1H-[1,2,3]triazole-4-carboxylic acid
  • SMILES O=C(O)C1=C(C)N(C2=CC=CC=C2F)N=N1

Synthesis

  • Route1
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      1147189-40-9
    • ~%
    • In-stock
      1-(2-Fluorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid|CS-0070604
      887035-85-0

    References

    • MERCK SERONO S.A. Patent: WO2009/80663 A1, 2009 ; Location in patent: Page/Page column 100-101 ; WO 2009/080663 A1

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

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Computational Chemistry Data

  • TPSA   68.01
  • LogP   1.41302
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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