1.0 2010-04-08 22:15:33 UTC 2019-11-26 03:20:04 UTC FDB021224 1-Methoxy-4-[5-(4-methoxyphenoxy)-3-penten-1-ynyl]benzene Constituent of the cultured cells of asparagus (Asparagus officinalis). 1-Methoxy-4-[5-(4-methoxyphenoxy)-3-penten-1-ynyl]benzene is found in green vegetables. 1-Methoxy-4-[5-(4-methoxyphenoxy)-3-penten-1-ynyl]benzene C19H18O3 294.3444 294.125594442 1-methoxy-4-{[(2Z)-5-(4-methoxyphenyl)pent-2-en-4-yn-1-yl]oxy}benzene 1-methoxy-4-{[(2Z)-5-(4-methoxyphenyl)pent-2-en-4-yn-1-yl]oxy}benzene 166762-96-5 COC1=CC=C(OC\C=C/C#CC2=CC=C(OC)C=C2)C=C1 InChI=1S/C19H18O3/c1-20-17-9-7-16(8-10-17)6-4-3-5-15-22-19-13-11-18(21-2)12-14-19/h3,5,7-14H,15H2,1-2H3/b5-3- ZWOWJNDTICMQMK-HYXAFXHYSA-N belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof. Anisoles Organic compounds Benzenoids Phenol ethers Anisoles Aromatic homomonocyclic compounds Alkyl aryl ethers Hydrocarbon derivatives Methoxybenzenes Phenoxy compounds Alkyl aryl ether Anisole Aromatic homomonocyclic compound Ether Hydrocarbon derivative Methoxybenzene Monocyclic benzene moiety Organic oxygen compound Organooxygen compound Phenoxy compound logp 3.94 ALOGPS logs -4.89 ALOGPS solubility 3.77e-03 g/l ALOGPS melting_point Mp 124-125.5° logp 4.23 ChemAxon pka_strongest_basic -4.3 ChemAxon iupac 1-methoxy-4-{[(2Z)-5-(4-methoxyphenyl)pent-2-en-4-yn-1-yl]oxy}benzene ChemAxon average_mass 294.3444 ChemAxon mono_mass 294.125594442 ChemAxon smiles COC1=CC=C(OC\C=C/C#CC2=CC=C(OC)C=C2)C=C1 ChemAxon formula C19H18O3 ChemAxon inchi InChI=1S/C19H18O3/c1-20-17-9-7-16(8-10-17)6-4-3-5-15-22-19-13-11-18(21-2)12-14-19/h3,5,7-14H,15H2,1-2H3/b5-3- ChemAxon inchikey ZWOWJNDTICMQMK-HYXAFXHYSA-N ChemAxon polar_surface_area 27.69 ChemAxon refractivity 86.01 ChemAxon polarizability 32.56 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 3 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 21788 Specdb::CMs 135273 Specdb::CMs 143007 Specdb::MsMs 314422 Specdb::MsMs 314423 Specdb::MsMs 314424 Specdb::MsMs 360166 Specdb::MsMs 360167 Specdb::MsMs 360168 Specdb::MsMs 2681811 Specdb::MsMs 2681812 Specdb::MsMs 2681813 Specdb::MsMs 3026775 Specdb::MsMs 3026776 Specdb::MsMs 3026777 HMDB41305 #<Reference:0x000055ce326381d8> Green vegetables Unknown generic