Ethanone, 1-(2,3-dihydro-6-benzofuranyl)- (9CI)
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Ethanone, 1-(2,3-dihydro-6-benzofuranyl)- (9CI)
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CAS No:
374706-07-7
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Formula:
C10H10O2
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Chemical Name:
Ethanone, 1-(2,3-dihydro-6-benzofuranyl)- (9CI)
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Synonyms:
Ethanone, 1-(2,3-dihydro-6-benzofuranyl)- (9CI);1-(2,3-DIHYDROBENZOFURAN-6-YL)ETHANONE
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CAS No:
Ethanone, 1-(2,3-dihydro-6-benzofuranyl)- (9CI) Use and Manufacturing
The title compound was prepared according to procedures reported in the literature and known by persons skill in the art, using 6-bromo-2, 3-dihydro-1-benzofuran (1 g, 5.03 mmol) as starting material. In a preferred method, 6-bromo-2, 3-dihydro-1-benzofuran (1 g, 5.03 mmol) in toluene (10 mL) was degassed for 30 min. To this solution, 1-ethoxyvinyl tributyltin (2.012 g, 5.53 mmol) and bis(triphenylphosphine)palladium dichloride (0.35 g, 0.50 mmol) were added at rt and stirred for 16 hours at 90 °C. The reaction mixture was cooled to rt and filtered through celite. After evaporation of the solvent, 6 N HCl solution in water (10 mL) was added and the mixture was stirred for 1 hour at rt. It was concentrated and neutralized with sat. NaHCO
Computed Properties
Molecular Weight:162.18
XLogP3:1.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:162.068079557
Monoisotopic Mass:162.068079557
Topological Polar Surface Area:26.3
Heavy Atom Count:12
Complexity:188
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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