5-Acetyl-2-(1-hydroxy-1-methylethyl)benzofuran

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5-Acetyl-2-(1-hydroxy-1-methylethyl)benzofuran
Category Others
Catalog number BBF-04451
CAS 64165-99-7
Molecular Weight 218.25
Molecular Formula C13H14O3
Purity 99.0%

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Description

5-Acetyl-2-(1-hydroxy-1-methylethyl)benzofuran is produced from the inoculation of sliced yacon tubers with Pseudomonas cichorii. It is a phytoalexin.

Specification

Synonyms Ethanone, 1-[2-(1-hydroxy-1-methylethyl)-5-benzofuranyl]-
Storage Store at 2-8°C
IUPAC Name 1-[2-(2-hydroxypropan-2-yl)-1-benzofuran-5-yl]ethanone
Canonical SMILES CC(=O)C1=CC2=C(C=C1)OC(=C2)C(C)(C)O
InChI InChI=1S/C13H14O3/c1-8(14)9-4-5-11-10(6-9)7-12(16-11)13(2,3)15/h4-7,15H,1-3H3
InChI Key JJKBKOOIAOIYSD-UHFFFAOYSA-N

Properties

Appearance Crystal
Boiling Point 356.0±27.0°C at 760 mmHg
Melting Point 73°C
Density 1.2±0.1 g/cm3
Solubility Soluble in Ether

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