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CS-W001157 4
Total: USD 88.00

Ethyl 2-cyano-2-cyclohexylideneacetate

  • CAS No. 6802-76-2

  • Cat. No. CS-W010687
  • Purity≥97%
  • MDL No.MFCD00089568

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

Ethyl 2-cyano-2-cyclohexylideneacetate|CS-W010687

Structure of 6802-76-2

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General Information

  • CAS No. 6802-76-2
  • Cat. No. CS-W010687
  • Purity ≥97%
  • MDL No. MFCD00089568
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₅NO₂
  • Molecular Weight 193.25
  • Synonym(s) NSC 10726
  • SMILES O=C(OCC)/C(C#N)=C1CCCCC\1

Synthesis

  • Route1
    • null|null
      108-94-1
    • null|null
      105-56-6
    • ~95%
    • Ethyl 2-cyano-2-cyclohexylideneacetate|CS-W010687
      6802-76-2

    References

    • Krishnan, G. Rajesh; Sreekumar, Krishnapillai European Journal of Organic Chemistry, 2008 , # 28 p. 4763 - 4768
  • Route2
    • null|null
      64-17-5
    • 2-Cyano-2-cyclohexylideneacetic acid|CS-0314065
      37107-50-9
    • ~%
    • Ethyl 2-cyano-2-cyclohexylideneacetate|CS-W010687
      6802-76-2

    References

    • Journal of the Chemical Society, , p. 2148
  • Route3
    • null|null
      108-94-1
    • ~%
    • Ethyl 2-cyano-2-cyclohexylideneacetate|CS-W010687
      6802-76-2

    References

    • Journal of the Chemical Society, , p. 2148

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   50.09
  • LogP   2.33378
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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