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CS-W001157 4
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3-(4-Chlorophenyl)-1-methyl-1H-pyrazol-5-ol

  • CAS No. 862588-62-3

  • Cat. No. CS-0366932
  • Purity≥98%
  • MDL No.MFCD09749444

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

3-(4-Chlorophenyl)-1-methyl-1H-pyrazol-5-ol|CS-0366932

Structure of 862588-62-3

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General Information

  • CAS No. 862588-62-3
  • Cat. No. CS-0366932
  • Purity ≥98%
  • MDL No. MFCD09749444
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉ClN₂O
  • Molecular Weight 208.65
  • Synonym(s) 5-(4-CHLOROPHENYL)-2,4-DIHYDRO-2-METHYL-3H-PYRAZOL-3-ONE
  • SMILES OC1=CC(C2=CC=C(Cl)C=C2)=NN1C

Synthesis

  • Route1
    • Methyl 3-(4-chlorophenyl)-3-oxopropanoate|CS-0067987
      22027-53-8
    • null|null
      60-34-4
    • ~%
    • 3-(4-Chlorophenyl)-1-methyl-1H-pyrazol-5-ol|CS-0366932
      862588-62-3

    References

    • SHENYANG RESEARCH INSTITUTE OF CHEMICAL INDUSTRY Patent: US2008/275070 A1, 2008 ; Location in patent: Page/Page column 9 ;
  • Route2

    References

    • Shenyang Research Institute of Chemical Industry Patent: EP1717231 A1, 2006 ; Location in patent: Page/Page column 25 ;
  • Route3
    • null|null
      99-91-2
    • ~%
    • 3-(4-Chlorophenyl)-1-methyl-1H-pyrazol-5-ol|CS-0366932
      862588-62-3

    References

    • Li, Miao; Liu, Chang-Ling; Yang, J.I.-Chun; Zhang, Jin-B.O.; Li, Zhi-Nian; Zhang, Hong; Li, Zheng-Ming Journal of Agricultural and Food Chemistry, 2010 , vol. 58, # 5 p. 2664 - 2667

Safety Information

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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   32.67
  • LogP   1.9062
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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