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CS-W001157 4
Total: USD 88.00

1-Cyclopropyl-6,7,8-trifluoro-4-oxoquinoline-3-carboxylic acid

  • CAS No. 94695-52-0

  • Cat. No. CS-0036600
  • Purity≥97%
  • MDL No.None

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

1-Cyclopropyl-6,7,8-trifluoro-4-oxoquinoline-3-carboxylic acid|CS-0036600

Structure of 94695-52-0

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General Information

  • CAS No. 94695-52-0
  • Cat. No. CS-0036600
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₈F₃NO₃
  • Molecular Weight 283.20
  • Synonym(s) 1-Cyclopropyl-6,7,8-trifluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
  • SMILES C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)F)F)F)C(=O)O

Synthesis

  • Route1
    • 1-Cyclopropyl-6,7,8-trifluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic Acid Ethyl Ester  Moxifloxacin Impurity|CS-0164478
      94242-51-0
    • ~83%
    • In-stock
      1-Cyclopropyl-6,7,8-trifluoro-4-oxoquinoline-3-carboxylic acid|CS-0036600
      94695-52-0

    References

    • Grohe, Klaus; Heitzer, Helmut Liebigs Annalen der Chemie, 1987 , p. 29 - 37
  • Route2
    • null|null
      7664-93-9
    • 1-Cyclopropyl-6,7,8-trifluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic Acid Ethyl Ester  Moxifloxacin Impurity|CS-0164478
      94242-51-0
    • ~%
    • In-stock
      1-Cyclopropyl-6,7,8-trifluoro-4-oxoquinoline-3-carboxylic acid|CS-0036600
      94695-52-0

    References

    • US4588726 A1, ;
  • Route3

    References

    • Journal of Medicinal Chemistry, , vol. 31, # 5 p. 991 - 1001

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   59.3
  • LogP   2.4519
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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