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Dimethyl 4-iodo-1H-pyrazole-3,5-dicarboxylate

  • CAS No. 1027819-68-6

  • Cat. No. CS-0053704
  • Molecule weight310.05
  • Purity≥97%
  • MDL No.MFCD08689740

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

Dimethyl 4-iodo-1H-pyrazole-3,5-dicarboxylate|CS-0053704

Structure of 1027819-68-6

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General Information

  • CAS No. 1027819-68-6
  • Cat. No. CS-0053704
  • Purity ≥97%
  • MDL No. MFCD08689740
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇IN₂O₄
  • Molecular Weight 310.05
  • Synonym(s) None
  • SMILES COC(=O)C1=C(I)C(=NN1)C(=O)OC

Synthesis

  • Route1

    References

    • Olguin, Juan; Brooker, Sally New Journal of Chemistry, 2011 , vol. 35, # 6 p. 1242 - 1253

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   81.28
  • LogP   0.5875
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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