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CS-W001157 4
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Ethyl 2-nitrobutanoate

  • CAS No. 2531-81-9

  • Cat. No. CS-0464943
  • Purity≥98%
  • MDL No.None

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

Ethyl 2-nitrobutanoate|CS-0464943

Structure of 2531-81-9

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General Information

  • CAS No. 2531-81-9
  • Cat. No. CS-0464943
  • 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) Ethyl 2-Nitrobutyrate
  • SMILES CCC(C(=O)OCC)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • Journal of the American Chemical Society, , vol. 79, p. 2507 US2816909 , ;
  • Route2

    References

    • Journal of the American Chemical Society, , vol. 78, p. 1497,1499
  • Route3
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      40561-27-1
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      18995-13-6
    • ~%
    • Ethyl 2-nitrobutanoate|CS-0464943
      2531-81-9

    References

    • Journal of the American Chemical Society, , vol. 77, p. 4387,4388 Journal of the American Chemical Society, , vol. 77, p. 6061,6062

Safety Information

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

Quality Control

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Computational Chemistry Data

  • TPSA   69.44
  • LogP   0.6048
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   4

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