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CS-W001157 4
Total: USD 88.00

Methyl 5-nitropentanoate

  • CAS No. 34805-47-5

  • Cat. No. CS-0516239
  • Purity≥98%
  • MDL No.None

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

Methyl 5-nitropentanoate|CS-0516239

Structure of 34805-47-5

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General Information

  • CAS No. 34805-47-5
  • Cat. No. CS-0516239
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₁NO₄
  • Molecular Weight 161.16
  • Synonym(s) 5-Nitropentanoic acid methyl ester
  • SMILES O=C(OC)CCCC[N+]([O-])=O

Synthesis

  • Route1

    References

    • ELI LILLY AND COMPANY Patent: WO2005/19184 A1, 2005 ; Location in patent: Page/Page column 59 ; WO 2005/019184 A1
  • Route2
    • null|null
      19129-92-1
    • ~%
    • Methyl 5-nitropentanoate|CS-0516239
      34805-47-5

    References

    • The Upjohn Company Patent: US4581462 A1, 1986 ;
  • Route3
    • null|null
      67-56-1
    • null|null
      22498-31-3
    • ~96%
    • Methyl 5-nitropentanoate|CS-0516239
      34805-47-5

    References

    • Ballini; Petrini; Polzonetti Synthesis, 1992 , # 4 p. 355 - 357

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   69.44
  • LogP   0.6064
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   5

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