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CS-W001157 4
Total: USD 88.00

1-Butyl-4-iodo-1H-pyrazole

  • CAS No. 918487-10-2

  • Cat. No. CS-0212662
  • Purity≥98%
  • MDL No.MFCD16036120

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

1-Butyl-4-iodo-1H-pyrazole|CS-0212662

Structure of 918487-10-2

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General Information

  • CAS No. 918487-10-2
  • Cat. No. CS-0212662
  • Purity ≥98%
  • MDL No. MFCD16036120
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₁IN₂
  • Molecular Weight 250.08
  • Synonym(s) 1-butyl-4-iodopyrazole
  • SMILES CCCCN1C=C(C=N1)I

Synthesis

  • Route1

    References

    • AKAAL PHARMA PTY LTD; GROBELNY, Damian W; GILL, Gurmit S Patent: WO2014/63199 A1, 2014 ; Location in patent: Page/Page column 37 ;
  • Route2

    References

    • Malamas, Michael S.; Erdei, Jim; Gunawan, Iwan; Barnes, Keith; Hui, Yu; Johnson, Matthew; Robichaud, Albert; Zhou, Ping; Yan, Yinfa; Solvibile, William; Turner, Jim; Fan, Kristi Yi; Chopra, Rajiv; Bard, Jonathan; Pangalos, Menelas N. Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 18 p. 5164 - 5170

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   17.82
  • LogP   2.2878
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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