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CS-W001157 4
Total: USD 88.00

3-Ethoxybenzonitrile

  • CAS No. 25117-75-3

  • Cat. No. CS-0159909
  • Purity≥95%
  • MDL No.MFCD00001805

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

3-Ethoxybenzonitrile|CS-0159909

Structure of 25117-75-3

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General Information

  • CAS No. 25117-75-3
  • Cat. No. CS-0159909
  • Purity ≥95%
  • MDL No. MFCD00001805
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉NO
  • Molecular Weight 147.17
  • Synonym(s) M-ETHOXYBENZONITRILE
  • SMILES N#CC1=CC=CC(OCC)=C1

Synthesis

  • Route1

    References

    • Anbarasan, Pazhamalai; Neumann, Helfried; Beller, Matthias Angewandte Chemie - International Edition, 2011 , vol. 50, # 2 p. 519 - 522
  • Route2
    • In-stock
      3-Hydroxybenzonitrile|CS-D1474
      873-62-1
    • null|null
      75-03-6
    • ~80%
    • In-stock
      3-Ethoxybenzonitrile|CS-0159909
      25117-75-3

    References

    • Osselton, E. M.; Lempers, E. L. M.; Eyken, C. P.; Cornelisse, J. Recueil des Travaux Chimiques des Pays-Bas, 1986 , vol. 105, # 6 p. 171 - 175
  • Route3
    • null|null
      621-33-0
    • ~%
    • In-stock
      3-Ethoxybenzonitrile|CS-0159909
      25117-75-3

    References

    • Journal of the American Chemical Society, , vol. 57, p. 545

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3276
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H302-H312-H315-H319-H331-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   33.02
  • LogP   1.95698
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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