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CS-W001157 4
Total: USD 88.00

Ethyl 2-cyano-2-(prop-2-en-1-yl)pent-4-enoate

  • CAS No. 3509-02-2

  • Cat. No. CS-0232012
  • Purity≥98%
  • MDL No.None

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

Ethyl 2-cyano-2-(prop-2-en-1-yl)pent-4-enoate|CS-0232012

Structure of 3509-02-2

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General Information

  • CAS No. 3509-02-2
  • Cat. No. CS-0232012
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₅NO₂
  • Molecular Weight 193.24
  • Synonym(s) ethyl 2-cyano-2-prop-2-enyl-pent-4-enoate
  • SMILES C=CCC(CC=C)(C#N)C(OCC)=O

Synthesis

  • Route1
    • null|null
      106-95-6
    • null|null
      105-56-6
    • ~68%
    • Ethyl 2-cyano-2-(prop-2-en-1-yl)pent-4-enoate|CS-0232012
      3509-02-2

    References

    • Necas, David; Tursky, Matyas; Tislerova, Iva; Kotora, Martin New Journal of Chemistry, 2006 , vol. 30, # 5 p. 671 - 674
  • Route2
    • null|null
      591-87-7
    • null|null
      105-56-6
    • ~89%
    • Ethyl 2-cyano-2-(prop-2-en-1-yl)pent-4-enoate|CS-0232012
      3509-02-2

    References

    • Vasil'ev, Andrei A.; Kuchurov, Ilya V.; Zlotin, Sergei G. Mendeleev Communications, 2013 , vol. 23, # 2 p. 84 - 85
  • Route3
    • null|null
      107-18-6
    • null|null
      105-56-6
    • ~96%
    • Ethyl 2-cyano-2-(prop-2-en-1-yl)pent-4-enoate|CS-0232012
      3509-02-2

    References

    • Bergbreiter, David E.; Weatherford, David A. Journal of the Chemical Society, Chemical Communications, 1989 , # 13 p. 883 - 884

Safety Information

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

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Computational Chemistry Data

  • TPSA   50.09
  • LogP   2.21168
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   6

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