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CS-W001157 4
Total: USD 88.00

Octyl 2-cyanoacetate

  • CAS No. 15666-97-4

  • Cat. No. CS-0152152
  • Purity≥98%
  • MDL No.MFCD00075425

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

Octyl 2-cyanoacetate|CS-0152152

Structure of 15666-97-4

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General Information

  • CAS No. 15666-97-4
  • Cat. No. CS-0152152
  • Purity ≥98%
  • MDL No. MFCD00075425
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₉NO₂
  • Molecular Weight 197.27
  • Synonym(s) Octyl cyanoacetate
  • SMILES CCCCCCCCOC(=O)CC#N

Synthesis

  • Route1
    • In-stock
      1-Octanol|CS-0076037
      111-87-5
    • null|null
      372-09-8
    • ~93%
    • In-stock
      Octyl 2-cyanoacetate|CS-0152152
      15666-97-4

    References

    • Bartoli; Boeglin; Bosco; Locatelli; Massaccesi; Melchiorre; Sambri Advanced Synthesis and Catalysis, 2005 , vol. 347, # 1 p. 33 - 38
  • Route2
    • null|null
      92445-22-2
    • ~%
    • In-stock
      Octyl 2-cyanoacetate|CS-0152152
      15666-97-4

    References

    • Tetrahedron, , vol. 41, # 5 p. 919 - 926
  • Route3
    • null|null
      97189-65-6
    • ~%
    • In-stock
      Octyl 2-cyanoacetate|CS-0152152
      15666-97-4

    References

    • Tetrahedron, , vol. 41, # 5 p. 919 - 926

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+H312+H332-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   50.09
  • LogP   2.80378
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   8

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