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Ethyl6-fluoroquinoline-3-carboxylate

  • CAS No. 71083-14-2

  • Cat. No. CS-0172323
  • Purity≥98%
  • MDL No.None

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

Ethyl6-fluoroquinoline-3-carboxylate|CS-0172323

Structure of 71083-14-2

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General Information

  • CAS No. 71083-14-2
  • Cat. No. CS-0172323
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₀FNO₂
  • Molecular Weight 219.21
  • Synonym(s) Ethyl 6-fluoroquinoline-3-carboxylate
  • SMILES CCOC(=O)C1=CN=C2C=CC(=CC2=C1)F

Synthesis

  • Route1

    References

    • JANSSEN PHARMACEUTICA N.V. Patent: WO2004/69792 A2, 2004 ; Location in patent: Page 168-169 ;
  • Route2

    References

    • Venkatesan, Hariharan; Hocutt, Frances M.; Jones, Todd K.; Rabinowitz, Michael H. Journal of Organic Chemistry, 2010 , vol. 75, # 10 p. 3488 - 3491

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

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Computational Chemistry Data

  • TPSA   39.19
  • LogP   2.5506
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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