3-(2-Methylpropylidene)-1(3H)-isobenzofuranone
IUPAC 名称
(3E)-3-(2-methylpropylidene)-1,3-dihydro-2-benzofuran-1-one
描述
3-(2-methylpropylidene)-1(3h)-isobenzofuranone is a member of the class of compounds known as isobenzofuranones. Isobenzofuranones are compounds containing a 2-benzofuran moiety that carries an oxo group at the 1 position. 3-(2-methylpropylidene)-1(3h)-isobenzofuranone is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 3-(2-methylpropylidene)-1(3h)-isobenzofuranone can be found in wild celery, which makes 3-(2-methylpropylidene)-1(3h)-isobenzofuranone a potential biomarker for the consumption of this food product.
异构
CC(C)\C=C1\OC(=O)C2=CC=CC=C12
InChI标识符
InChI=1S/C12H12O2/c1-8(2)7-11-9-5-3-4-6-10(9)12(13)14-11/h3-8H,1-2H3/b11-7+
键
LYSNVWBBICAAMS-YRNVUSSQSA-N