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CS-W001157 4
Total: USD 88.00

Ethyl 1-cyanocyclohexane-1-carboxylate

  • CAS No. 1130-21-8

  • Cat. No. CS-0210093
  • Purity≥98%
  • MDL No.MFCD19313902

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

Ethyl 1-cyanocyclohexane-1-carboxylate|CS-0210093

Structure of 1130-21-8

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General Information

  • CAS No. 1130-21-8
  • Cat. No. CS-0210093
  • Purity ≥98%
  • MDL No. MFCD19313902
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₅NO₂
  • Molecular Weight 181.23
  • Synonym(s) Ethyl 1-cyanocyclohexanecarboxylate
  • SMILES CCOC(=O)C1(CCCCC1)C#N

Synthesis

  • Route1
    • null|null
      111-24-0
    • null|null
      105-56-6
    • ~76%
    • In-stock
      Ethyl 1-cyanocyclohexane-1-carboxylate|CS-0210093
      1130-21-8

    References

    • Varie, David L.; Shih, Chuan; Hay, David A; Andis, Sherri L.; Corbett, Tom H.; Gossett, Lynn S.; Janisse, Samantha K.; Martinelli, Michael J.; Moher, Eric D.; Schultz, Richard M.; Toth, John E. Bioorganic and Medicinal Chemistry Letters, 1999 , vol. 9, # 3 p. 369 - 374
  • Route2
    • In-stock
      Iodocyclohexane,98% (stabilized with Cu)|CS-0148628
      626-62-0
    • null|null
      105-56-6
    • ~59%
    • In-stock
      Ethyl 1-cyanocyclohexane-1-carboxylate|CS-0210093
      1130-21-8

    References

    • He, Tian; Gao, Wen-Chao; Wang, Wei-Kun; Zhang, Chi Advanced Synthesis and Catalysis, 2014 , vol. 356, # 5 p. 1113 - 1118
  • Route3
    • null|null
      111-24-0
    • null|null
      2999-46-4
    • ~56%
    • In-stock
      Ethyl 1-cyanocyclohexane-1-carboxylate|CS-0210093
      1130-21-8

    References

    • Kalvin, Douglas; Ramalingam, Kondareddiar; Woodward, Ronald Synthetic Communications, 1985 , vol. 15, # 4 p. 267 - 272

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   50.09
  • LogP   2.02358
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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