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CS-W001157 4
Total: USD 88.00

Ethyl 2-(cyanomethyl)benzoate

  • CAS No. 19821-21-7

  • Cat. No. CS-0037673
  • Purity≥96%
  • MDL No.MFCD00062509

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

Ethyl 2-(cyanomethyl)benzoate|CS-0037673

Structure of 19821-21-7

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General Information

  • CAS No. 19821-21-7
  • Cat. No. CS-0037673
  • Purity ≥96%
  • MDL No. MFCD00062509
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁NO₂
  • Molecular Weight None
  • Synonym(s) Ethyl 2-cyanoMethylbenzoate
  • SMILES O=C(OCC)C1=CC=CC=C1CC#N

Synthesis

  • Route1
    • In-stock
      HSL-IN-3|CS-0103132
      346656-34-6
    • null|null
      590-17-0
    • ~63%
    • In-stock
      Ethyl 2-(cyanomethyl)benzoate|CS-0037673
      19821-21-7

    References

    • Yang, Yingying; Tang, Shan; Liu, Chao; Zhang, Huimin; Sun, Zhexun; Lei, Aiwen Organic and Biomolecular Chemistry, 2011 , vol. 9, # 15 p. 5343 - 5345
  • Route2

    References

    • Price et al. Journal of the American Chemical Society, 1939 , vol. 61, p. 2760
  • Route3
    • null|null
      151-50-8
    • In-stock
      Ethyl 2-(bromomethyl)benzoate|CS-0695446
      7115-91-5
    • ~77%
    • In-stock
      Ethyl 2-(cyanomethyl)benzoate|CS-0037673
      19821-21-7

    References

    • Canepa, Alicia S.; Bravo, Rodolfo D. Synthetic Communications, 2004 , vol. 34, # 4 p. 579 - 588

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3439
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301+H311+H331-H315-H319
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361+P364-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   50.09
  • LogP   1.92938
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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