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CS-W001157 4
Total: USD 88.00

2-Chloro-4-nitrobenzonitrile

  • CAS No. 28163-00-0

  • Cat. No. CS-W017084
  • Purity≥96%
  • MDL No.MFCD00052203

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

2-Chloro-4-nitrobenzonitrile|CS-W017084

Structure of 28163-00-0

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General Information

  • CAS No. 28163-00-0
  • Cat. No. CS-W017084
  • Purity ≥96%
  • MDL No. MFCD00052203
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₃ClN₂O₂
  • Molecular Weight None
  • Synonym(s) 2-chloro-4-nitrobenzenecarbonitrile
  • SMILES N#CC1=CC=C([N+]([O-])=O)C=C1Cl

Synthesis

  • Route1

    References

    • Yokoyama, Masataka; Yoshida, Sayaka; Imamoto, Tsuneo Synthesis, 1982 , # 7 p. 591 - 592
  • Route2

    References

    • Du, Bingnan; Jiang, Xiaoqing; Sun, Peipei Journal of Organic Chemistry, 2013 , vol. 78, # 6 p. 2786 - 2791
  • Route3
    • null|null
      98606-58-7
    • ~86%
    • In-stock
      2-Chloro-4-nitrobenzonitrile|CS-W017084
      28163-00-0
    • N,N-Dimethyl-N'-phenylcarbamimidic chloride|CS-0300177
      7684-30-2

    References

    • Kokel, Bruno; Menichi, Gabriel; Hubert-Habart, Michel Synthesis, 1985 , # 2 p. 201 - 202

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   66.93
  • LogP   2.11988
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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