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CS-W001157 4
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1-(4-Iodo-1H-pyrazol-1-yl)ethan-1-one

  • CAS No. 98027-52-2

  • Cat. No. CS-0067226
  • Molecule weight236.01
  • Purity≥97%
  • MDL No.MFCD09744025

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

1-(4-Iodo-1H-pyrazol-1-yl)ethan-1-one|CS-0067226

Structure of 98027-52-2

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General Information

  • CAS No. 98027-52-2
  • Cat. No. CS-0067226
  • Purity ≥97%
  • MDL No. MFCD09744025
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₅IN₂O
  • Molecular Weight 236.01
  • Synonym(s) 1-acetyl-4-iodo-1H-pyrazole
  • SMILES CC(N1N=CC(I)=C1)=O

Synthesis

  • Route1
    • In-stock
      4-Iodopyrazole|CS-W008950
      3469-69-0
    • null|null
      75-36-5
    • ~93%
    • In-stock
      1-(4-Iodo-1H-pyrazol-1-yl)ethan-1-one|CS-0067226
      98027-52-2

    References

    • Jacques, Vincent; Rusche, James R.; Peet, Norton P.; Singh, Jasbir Patent: US2013/317003 A1, 2013 ; Location in patent: Paragraph 0479 ;

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   34.89
  • LogP   1.1478
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   0

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