Organofluorine / Alfa Chemistry
Quinolin-6-yl 2,2,2-trifluoroacetate

Quinolin-6-yl 2,2,2-trifluoroacetate

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Quinolin-6-yl 2,2,2-trifluoroacetate
Catalog OFC1000775187
CAS 1000775-18-7
Category Fluorinated Quinolines
Synonyms Quinolin-6-yl trifluoroacetate
Purity 97%
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name quinolin-6-yl 2,2,2-trifluoroacetate
InChI InChI=1S/C11H6F3NO2/c12-11(13,14)10(16)17-8-3-4-9-7(6-8)2-1-5-15-9/h1-6H
InChI Key VSHPSUYOQMHUET-UHFFFAOYSA-N
Isomeric SMILES C1=CC2=C(C=CC(=C2)OC(=O)C(F)(F)F)N=C1
Molecular Formula C11H6F3NO2
Molecular Weight 241.17
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 2
Exact Mass 241.03506292 g/mol
Monoisotopic Mass 241.03506292 g/mol
Topological Polar Surface Area 39.2Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 293

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