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tert-Butyl 8-hydroxy-3,4-dihydroquinoline-1(2H)-carboxylate

  • CAS No. 676255-10-0

  • Cat. No. CS-0136414
  • Purity≥96%
  • MDL No.None

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

tert-Butyl 8-hydroxy-3,4-dihydroquinoline-1(2H)-carboxylate|CS-0136414

Structure of 676255-10-0

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General Information

  • CAS No. 676255-10-0
  • Cat. No. CS-0136414
  • Purity ≥96%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₉NO₃
  • Molecular Weight 249.31
  • Synonym(s) 8-hydroxy-3,4-dihydro-2H-quinoline-1-carboxylic acid tert-butyl ester
  • SMILES O=C(N1CCCC2=C1C(O)=CC=C2)OC(C)(C)C

Synthesis

  • Route1

    References

    • ELI LILLY AND COMPANY Patent: WO2004/26837 A2, 2004 ; Location in patent: Page 24 ; WO 2004/026837 A2
  • Route2

    References

    • Jesudason, Cynthia D.; Beavers, Lisa S.; Cramer, Jeffrey W.; Dill, Joelle; Finley, Don R.; Lindsley, Craig W.; Stevens, F. Craig; Gadski, Robert A.; Oldham, Samuel W.; Pickard, R. Todd; Siedem, Christopher S.; Sindelar, Dana K.; Singh, Ajay; Watson, Brian M.; Hipskind, Philip A. Bioorganic and Medicinal Chemistry Letters, 2006 , vol. 16, # 13 p. 3415 - 3418
  • Route3

    References

    • Jesudason, Cynthia D.; Beavers, Lisa S.; Cramer, Jeffrey W.; Dill, Joelle; Finley, Don R.; Lindsley, Craig W.; Stevens, F. Craig; Gadski, Robert A.; Oldham, Samuel W.; Pickard, R. Todd; Siedem, Christopher S.; Sindelar, Dana K.; Singh, Ajay; Watson, Brian M.; Hipskind, Philip A. Bioorganic and Medicinal Chemistry Letters, 2006 , vol. 16, # 13 p. 3415 - 3418

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   49.77
  • LogP   3.0799
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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