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CS-W001157 4
Total: USD 88.00

3-Iodobenzonitrile

  • CAS No. 69113-59-3

  • Cat. No. CS-W010393
  • Purity≥97%
  • MDL No.MFCD00079762

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

3-Iodobenzonitrile|CS-W010393

Structure of 69113-59-3

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General Information

  • CAS No. 69113-59-3
  • Cat. No. CS-W010393
  • Purity ≥97%
  • MDL No. MFCD00079762
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄IN
  • Molecular Weight 229.02
  • Synonym(s) 3-Cyano-1-iodobenzene
  • SMILES N#CC1=CC=CC(I)=C1

Synthesis

  • Route1

    References

    • Kim, Jinho; Stahl, Shannon S. ACS Catalysis, 2013 , vol. 3, # 7 p. 1652 - 1656
  • Route2
    • null|null
      2237-30-1
    • ~81%
    • In-stock
      3-Iodobenzonitrile|CS-W010393
      69113-59-3

    References

    • Malet-Sanz, Laia; Madrzak, Julia; Holvey, Rhian S.; Underwood, Toby Tetrahedron Letters, 2009 , vol. 50, # 52 p. 7263 - 7267
  • Route3

    References

    • US4579848 A1, ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3439
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H312-H315-H319-H332-H335
Precautionary Statements : P264-P270-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   2.16288
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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