Organofluorine / Alfa Chemistry
1,1,1-Trifluoro-4-phenylbut-3-yn-2-one

1,1,1-Trifluoro-4-phenylbut-3-yn-2-one

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1,1,1-Trifluoro-4-phenylbut-3-yn-2-one
Catalog OFC58518084
CAS 58518-08-4
Category Other Fluorinated Group Introducing Agents
Synonyms phenylacetylenyl trifluoromethyl ketone
3-Butyn-2-one, 1,1,1-trifluoro-4-phenyl-
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Other Identifiers Chemical Data Computational Chemistry
InChI InChI=1S/C10H5F3O/c11-10(12,13)9(14)7-6-8-4-2-1-3-5-8/h1-5H
InChI Key LISOVATZGSPQOC-UHFFFAOYSA-N
Canonical SMILES O=C(C#Cc1ccccc1)C(F)(F)F
Molecular Formula C10H5F3O
Molecular Weight 198.143
Boiling Point 94.0 °C
Density 1.3 g/cm3
Exact Mass 198.0292

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