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2,8-Bis(trifluoromethyl)-4-quinolinecarboxylic acid
[CAS# 35853-50-0]

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Identification
Name 2,8-Bis(trifluoromethyl)-4-quinolinecarboxylic acid
Synonyms 2,8-Bis(Trifluoromethyl)-4-Quinolinecarboxylic Acid; 2,8-Bis(Trifluoromethyl)Cinchoninic Acid; Cc-Pmlsc-Dma-P115
Molecular Structure CAS#: 35853-50-0, 2,8-Bis(trifluoromethyl)-4-quinolinecarboxylic acid
Molecular Formula C12H5F6NO2
Molecular Weight 309.17
CAS Registry Number 35853-50-0
SMILES C2=C(C1=CC=CC(=C1N=C2C(F)(F)F)C(F)(F)F)C(=O)O
InChI 1S/C12H5F6NO2/c13-11(14,15)7-3-1-2-5-6(10(20)21)4-8(12(16,17)18)19-9(5)7/h1-4H,(H,20,21)
InChIKey QJTJIQBSZLFWFS-UHFFFAOYSA-N
Properties
Density 1.575g/cm3 (Cal.)
Boiling point 330.842°C at 760 mmHg (Cal.)
Flash point 153.888°C (Cal.)
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