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CS-W001157 4
Total: USD 88.00

2-Chloro-4-fluoro-5-nitrobenzonitrile

  • CAS No. 183325-39-5

  • Cat. No. CS-0196911
  • Purity≥97%
  • MDL No.None

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

2-Chloro-4-fluoro-5-nitrobenzonitrile|CS-0196911

Structure of 183325-39-5

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General Information

  • CAS No. 183325-39-5
  • Cat. No. CS-0196911
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₂ClFN₂O₂
  • Molecular Weight 200.55
  • Synonym(s) Benzaldehyde,2-chloro-4-fluoro-5-nitro
  • SMILES C1=C(C#N)C(=CC(=C1[N+](=O)[O-])F)Cl

Synthesis

  • Route1

    References

    • BOEHRINGER INGELHEIM INTERNATIONAL GMBH Patent: US2012/309738 A1, 2012 ; Location in patent: Page/Page column 44 ; US 20120309738 A1
  • Route2
    • In-stock
      2-Chloro-4-fluorobenzonitrile|CS-W018016
      60702-69-4
    • ~25%
    • 2-Chloro-4-fluoro-5-nitrobenzamide|CS-1204162
      862875-20-5
    • In-stock
      2-Chloro-4-fluoro-5-nitrobenzonitrile|CS-0196911
      183325-39-5

    References

    • MERCK PATENT GMBH Patent: WO2005/75425 A2, 2005 ; Location in patent: Page/Page column 219 ; WO 2005/075425 A2

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-H312-H315-H319-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362-P405-P501

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Computational Chemistry Data

  • TPSA   66.93
  • LogP   2.25898
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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