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CS-W001157 4
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1-Nitropentane

  • CAS No. 628-05-7

  • Cat. No. CS-0222574
  • Molecule weight117.15
  • Purity≥98%
  • MDL No.None

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

1-Nitropentane|CS-0222574

Structure of 628-05-7

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General Information

  • CAS No. 628-05-7
  • Cat. No. CS-0222574
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₁₁NO₂
  • Molecular Weight 117.15
  • Synonym(s) Pentane, 1-nitro-
  • SMILES C(CCCC)[N+](=O)[O-]

Description

Ferroxime(II)-catalyzed oxidative denitrification of 1-nitropentane has been reported.1-Nitropentane has been used as organic nitrogen (ON) standard in quantitative method for the speciation of ON within ambient atmospheric aerosol.

Synthesis

  • Route1
    • null|null
      66022-60-4
    • ~%
    • 1-Nitropentane|CS-0222574
      628-05-7

    References

    • Meyers,A.I.; Sircar,J.C. Journal of Organic Chemistry, 1967 , vol. 32, p. 4134 - 4136
  • Route2

    References

    • Fishwick, Brian R.; Rowles, David K.; Stirling, Charles J. M. Journal of the Chemical Society, Chemical Communications, 1983 , # 15 p. 835 - 836
  • Route3
    • null|null
      110-53-2
    • ~%
    • 1-Nitropentane|CS-0222574
      628-05-7

    References

    • Plummer; Drake Journal of the American Chemical Society, 1954 , vol. 76, p. 2720

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H227-H315-H319-H335
Precautionary Statements : P210-P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P370+P378-P403-P405-P501

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Computational Chemistry Data

  • TPSA   43.14
  • LogP   1.4533
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   4

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