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CS-W001157 4
Total: USD 88.00

N-(5-methoxy-2-methyl-4-nitrophenyl)acetamide

  • CAS No. 361162-90-5

  • Cat. No. CS-0327561
  • Molecule weight224.21
  • Purity95+%
  • MDL No.None

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

N-(5-methoxy-2-methyl-4-nitrophenyl)acetamide|CS-0327561

Structure of 361162-90-5

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General Information

  • CAS No. 361162-90-5
  • Cat. No. CS-0327561
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂N₂O₄
  • Molecular Weight 224.21
  • Synonym(s) 2-AcetaMido-4-Methoxy-5-nitrotoluene
  • SMILES CC1=CC([N+]([O-])=O)=C(OC)C=C1NC(C)=O

Synthesis

  • Route1

    References

    • Arora, Nidhi; Chen, Shaoqing; Hermann, Johannes Cornelius; Kuglstatter, Adreas; Labadie, Sharada Shenvi; Lin, Clara Jeou Jen; Lucas, Matthew C.; Moore, Amy Geraldine; Papp, Eva; Talamas, Francisco Xavier; Wanner, Jutta; Zhai, Yansheng Patent: US2012/15962 A1, 2012 ; Location in patent: Page/Page column 89 ; US 20120015962 A1
  • Route2
    • 5-Methoxy-2-methyl-4-nitroaniline|CS-0128595
      106579-00-4
    • null|null
      108-24-7
    • ~66%
    • N-(5-methoxy-2-methyl-4-nitrophenyl)acetamide|CS-0327561
      361162-90-5

    References

    • Wissner, Allan; Overbeek, Elsebe; Reich, Marvin F.; Floyd, M. Brawner; Johnson, Bernard D.; Mamuya, Nellie; Rosfjord, Edward C.; Discafani, Carolyn; Davis, Rachel; Shi, Xiaoqing; Rabindran, Sridhar K.; Gruber, Brian C.; Ye, Fei; Hallett, William A.; Nilakantan, Ramaswamy; Shen, Ru; Wang, Yu-Fen; Greenberger, Lee M.; Tsou, Hwei-Ru Journal of Medicinal Chemistry, 2003 , vol. 46, # 1 p. 49 - 63
  • Route3

    References

    • Arora, Nidhi; Chen, Shaoqing; Hermann, Johannes Cornelius; Kuglstatter, Adreas; Labadie, Sharada Shenvi; Lin, Clara Jeou Jen; Lucas, Matthew C.; Moore, Amy Geraldine; Papp, Eva; Talamas, Francisco Xavier; Wanner, Jutta; Zhai, Yansheng Patent: US2012/15962 A1, 2012 ; US 20120015962 A1

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   81.47
  • LogP   1.87022
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   3

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