1.02011-09-26 22:55:31 UTC2015-07-21 07:00:44 UTCFDB0297375-methoxy-6-(2-propenyl)-1,3-benzodioxoleFlavouring compound [Flavornet]C11H12O3192.214192.0786442465-methoxy-6-(prop-2-en-1-yl)-2H-1,3-benzodioxolesarisan18607-93-7COC1=CC2=C(OCO2)C=C1CC=CInChI=1S/C11H12O3/c1-3-4-8-5-10-11(14-7-13-10)6-9(8)12-2/h3,5-6H,1,4,7H2,2H3FYRHTIWFKXZWAD-UHFFFAOYSA-N belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.BenzodioxolesOrganic compoundsOrganoheterocyclic compoundsBenzodioxolesAromatic heteropolycyclic compoundsAcetalsAlkyl aryl ethersAnisolesHydrocarbon derivativesOxacyclic compoundsAcetalAlkyl aryl etherAnisoleAromatic heteropolycyclic compoundBenzenoidBenzodioxoleEtherHydrocarbon derivativeOrganic oxygen compoundOrganooxygen compoundOxacyclebenzodioxoleslogp2.46logs-2.33solubility8.94e-01 g/llogp2.54pka_strongest_basic-4.5iupac5-methoxy-6-(prop-2-en-1-yl)-2H-1,3-benzodioxoleaverage_mass192.214mono_mass192.078644246smilesCOC1=CC2=C(OCO2)C=C1CC=CformulaC11H12O3inchiInChI=1S/C11H12O3/c1-3-4-8-5-10-11(14-7-13-10)6-9(8)12-2/h3,5-6H,1,4,7H2,2H3inchikeyFYRHTIWFKXZWAD-UHFFFAOYSA-Npolar_surface_area27.69refractivity52.58polarizability20.19rotatable_bond_count3acceptor_count3donor_count0physiological_charge0formal_charge0Specdb::MsMs1333651Specdb::MsMs1333652Specdb::MsMs1333653Specdb::MsMs1447882Specdb::MsMs1447883Specdb::MsMs1447884Specdb::MsMs3607333Specdb::MsMs3607334Specdb::MsMs3607335Specdb::MsMs3607336Specdb::MsMs3607337Specdb::MsMs3607338pepperspice