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CS-W001157 4
Total: USD 88.00

3-Ethoxyisonicotinic acid

  • CAS No. 78790-88-2

  • Cat. No. CS-0043812
  • Purity≥95%
  • MDL No.MFCD11100049

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

3-Ethoxyisonicotinic acid|CS-0043812

Structure of 78790-88-2

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General Information

  • CAS No. 78790-88-2
  • Cat. No. CS-0043812
  • Purity ≥95%
  • MDL No. MFCD11100049
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉NO₃
  • Molecular Weight 167.16
  • Synonym(s) None
  • SMILES O=C(O)C1=CC=NC=C1OCC

Synthesis

  • Route1
    • 3-Ethoxyisonicotinonitrile|CS-0970626
      78790-86-0
    • ~96%
    • 3-Ethoxyisonicotinic acid|CS-0043812
      78790-88-2

    References

    • LaMattina, John L.; Taylor, Richard L. Journal of Organic Chemistry, 1981 , vol. 46, # 21 p. 4179 - 4182
  • Route2

    References

    • LaMattina, John L.; Taylor, Richard L. Journal of Organic Chemistry, 1981 , vol. 46, # 21 p. 4179 - 4182

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   59.42
  • LogP   1.1785
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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