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CS-W001157 4
Total: USD 88.00

Tert-butyl methyl(1-(4-nitrophenyl)pyrrolidin-3-yl)carbamate

  • CAS No. 863401-75-6

  • Cat. No. CS-0466687
  • Purity≥98%
  • MDL No.None

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

Tert-butyl methyl(1-(4-nitrophenyl)pyrrolidin-3-yl)carbamate|CS-0466687

Structure of 863401-75-6

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General Information

  • CAS No. 863401-75-6
  • Cat. No. CS-0466687
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₂₃N₃O₄
  • Molecular Weight 321.37
  • Synonym(s) Methyl-[1-(4-nitro-phenyl)-pyrrolidin-3-yl]-carbaMic acid tert-butyl ester
  • SMILES CC(C)(C)OC(=O)N(C)C1CCN(C1)C2=CC=C(C=C2)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • Huang, Charles Q.; Baker, Tracy; Schwarz, David; Fan, Jun; Heise, Christopher E.; Zhang, Mingzhu; Goodfellow, Val S.; Markison, Stacy; Gogas, Kathleen R.; Chen, Takung; Wang, Xiao-Chuan; Zhu, Yun-Fei Bioorganic and Medicinal Chemistry Letters, 2005 , vol. 15, # 16 p. 3701 - 3706

Safety Information

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

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Computational Chemistry Data

  • TPSA   75.92
  • LogP   3.0404
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   3

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