Organofluorine / Alfa Chemistry
N-Fluoroquininine tetrafluoroborate

N-Fluoroquininine tetrafluoroborate

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N-Fluoroquininine tetrafluoroborate
Catalog OFC313696536
CAS 313696-53-6
Category Other Fluorinated Group Introducing Agents
Synonyms NF-Q·BF4
Cinchonanium, 1-fluoro-9-hydroxy-6'-methoxy-, (8α,9R)-, tetrafluoroborate
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Other Identifiers Chemical Data Computational Chemistry
InChI InChI=1S/C20H24FN2O2.BF4/c1-3-13-12-23(21)9-7-14(13)10-19(23)20(24)16-6-8-22-18-5-4-15(25-2)11-17(16)18;2-1(3,4)5/h3-6,8,11,13-14,19-20,24H,1,7,9-10,12H2,2H3;/q+1;-1/t13-,14-,19-,20+,23+;/m0./s1
InChI Key AAOMSEPFTFSATO-WRFQHGSDSA-N
Canonical SMILES C=C[C@H]1C[N@+]2(F)CC[C@H]1C[C@H]2[C@H](O)c1ccnc2ccc(OC)cc12.F[B-](F)(F)F
Molecular Formula C20H24BF5N2O2
Molecular Weight 430.226
Melting Point 138-140 °C
Appearance colorless crystals
Exact Mass 430.1851

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