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CS-W001157 4
Total: USD 88.00

3-Iodo-4-nitrophenol

  • CAS No. 50590-07-3

  • Cat. No. CS-W019053
  • Purity≥96%
  • MDL No.MFCD11617270

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

3-Iodo-4-nitrophenol|CS-W019053

Structure of 50590-07-3

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General Information

  • CAS No. 50590-07-3
  • Cat. No. CS-W019053
  • Purity ≥96%
  • MDL No. MFCD11617270
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₄INO₃
  • Molecular Weight 265.01
  • Synonym(s) None
  • SMILES OC1=CC=C([N+]([O-])=O)C(I)=C1

Synthesis

  • Route1

    References

    • VAN ANDEL RESEARCH INSTITUTE Patent: WO2005/95347 A1, 2005 ; Location in patent: Page/Page column 41 ;
  • Route2

    References

    • GLENMARK PHARMACEUTICAL S.A.; GHARAT, Laxmikant, Atmaram; NARAYANA, Lakshminarayana; YADAV, Pravin, Sabhajit; KHAIRATKAR-JOSHI, Neelima; BAJPAI, Malini Patent: WO2011/132048 A1, 2011 ; Location in patent: Page/Page column 42 ; WO 2011/132048 A1
  • Route3
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      799767-58-1
    • ~%
    • In-stock
      3-Iodo-4-nitrophenol|CS-W019053
      50590-07-3

    References

    • Hodgson; Moore Journal of the Chemical Society, 1925 , vol. 127, p. 2263 Journal of the Chemical Society, 1927 , p. 632

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS07,GHS09
Signal Word : Danger
UN#: 3077
Class : 9
Packing Group : Ⅲ
Hazard Statements : H302-H315-H317-H318-H410
Precautionary Statements : P261-P264-P270-P272-P273-P280-P302+P352-P330-P362+P364-P391-P501

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Computational Chemistry Data

  • TPSA   63.37
  • LogP   1.905
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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