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CS-W001157 4
Total: USD 88.00

1-(5-Chloro-2-nitrophenyl)pyrrolidine

  • CAS No. 133387-30-1

  • Cat. No. CS-0357886
  • Purity95+%
  • MDL No.None

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

1-(5-Chloro-2-nitrophenyl)pyrrolidine|CS-0357886

Structure of 133387-30-1

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General Information

  • CAS No. 133387-30-1
  • Cat. No. CS-0357886
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁ClN₂O₂
  • Molecular Weight 226.66
  • Synonym(s) 1-(5-CHLORO-2-NITRO-PHENYL)-PYRROLIDINE
  • SMILES C1CCN(C1)C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • ELI LILLY AND COMPANY Patent: WO2005/54202 A1, 2005 ; Location in patent: Page/Page column 29 ; WO 2005/054202 A1
  • Route2
    • null|null
      123-75-1
    • null|null
      611-06-3
    • ~91%
    • 1-(5-Chloro-2-nitrophenyl)pyrrolidine|CS-0357886
      133387-30-1

    References

    • Toma, Gabriel; Yamaguchi, Ryohei European Journal of Organic Chemistry, 2010 , # 33 p. 6404 - 6408
  • Route3
    • null|null
      123-75-1
    • null|null
      611-06-3
    • ~86%
    • null|null
      133387-31-2
    • 1-(5-Chloro-2-nitrophenyl)pyrrolidine|CS-0357886
      133387-30-1
    • null|null
      133387-33-4

    References

    • Bulletin of the Chemical Society of Japan, , vol. 64, # 1 p. 42 - 49

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   46.38
  • LogP   2.8484
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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