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CS-W001157 4
Total: USD 88.00

N-Butyl-3-nitrobenzamide

  • CAS No. 70001-47-7

  • Cat. No. CS-0205870
  • Purity≥98%
  • MDL No.MFCD00458983

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

N-Butyl-3-nitrobenzamide|CS-0205870

Structure of 70001-47-7

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General Information

  • CAS No. 70001-47-7
  • Cat. No. CS-0205870
  • Purity ≥98%
  • MDL No. MFCD00458983
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄N₂O₃
  • Molecular Weight 222.24
  • Synonym(s) None
  • SMILES O=C(NCCCC)C1=CC=CC(=C1)N(=O)=O

Synthesis

  • Route1
    • null|null
      645-00-1
    • null|null
      109-73-9
    • null|null
      13939-06-5
    • ~82%
    • N-Butyl-3-nitrobenzamide|CS-0205870
      70001-47-7

    References

    • Nordeman, Patrik; Odell, Luke R.; Larhed, Mats Journal of Organic Chemistry, 2012 , vol. 77, # 24 p. 11393 - 11398
  • Route2
    • null|null
      109-73-9
    • null|null
      121-90-4
    • ~51%
    • N-Butyl-3-nitrobenzamide|CS-0205870
      70001-47-7

    References

    • Yu, Ying; Yao, Yuan; Wang, Liyan; Li, Zesheng Langmuir, 2010 , vol. 26, # 5 p. 3275 - 3279
  • Route3
    • null|null
      38120-09-1
    • null|null
      109-73-9
    • ~%
    • null|null
      67-66-3
    • N-Butyl-3-nitrobenzamide|CS-0205870
      70001-47-7

    References

    • Druzian, Janice; Zucco, Cesar; Rezende, Marcos Caroli; Nome, Faruk Journal of Organic Chemistry, 1989 , vol. 54, # 20 p. 4767 - 4771

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   72.24
  • LogP   2.1247
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   5

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