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CS-W001157 4
Total: USD 88.00

Benzyl 2-cyanoacetate

  • CAS No. 14447-18-8

  • Cat. No. CS-0148613
  • Molecule weight175.19
  • Purity≥98%
  • MDL No.MFCD00051719

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

Benzyl 2-cyanoacetate|CS-0148613

Structure of 14447-18-8

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General Information

  • CAS No. 14447-18-8
  • Cat. No. CS-0148613
  • Purity ≥98%
  • MDL No. MFCD00051719
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉NO₂
  • Molecular Weight 175.19
  • Synonym(s) Benzyl cyanoacetate
  • SMILES N#CCC(=O)OCC=1C=CC=CC1

Synthesis

  • Route1
    • null|null
      372-09-8
    • In-stock
      Benzyl alcohol|CS-4355
      100-51-6
    • ~99%
    • In-stock
      Benzyl 2-cyanoacetate|CS-0148613
      14447-18-8

    References

    • Luetjens, Henning; Zickgraf, Andrea; Figler, Heidi; Linden, Joel; Olsson, Ray A.; Scammells, Peter J. Journal of Medicinal Chemistry, 2003 , vol. 46, # 10 p. 1870 - 1877
  • Route2
    • null|null
      51354-16-6
    • ~87%
    • In-stock
      Benzyl 2-cyanoacetate|CS-0148613
      14447-18-8

    References

    • SANOFI PASTEUR SA Patent: US2008/242857 A1, 2008 ; Location in patent: Page/Page column 17 ;
  • Route3
    • null|null
      105-56-6
    • In-stock
      Benzyl alcohol|CS-4355
      100-51-6
    • ~36%
    • In-stock
      Benzyl 2-cyanoacetate|CS-0148613
      14447-18-8

    References

    • Motokura, Ken; Fujita, Noriaki; Mori, Kohsuke; Mizugaki, Tomoo; Ebitani, Kohki; Jitsukawa, Koichiro; Kaneda, Kiyotomi Chemistry - A European Journal, 2006 , vol. 12, # 32 p. 8228 - 8239

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3439
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H302-H412
Precautionary Statements : P264-P270-P273-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   50.09
  • LogP   1.64348
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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