1.0 2010-04-08 22:10:05 UTC 2019-11-26 03:06:32 UTC FDB012288 1,2,3,4-Tetramethoxy-5-(2-propenyl)benzene Isolated from parsley oil and other Petroselinum subspecies 1,2,3,4-Tetramethoxy-5-(2-propenyl)benzene is found in herbs and spices and parsley. 1-Allyl-2,3,4,5-tetramethoxy-benzene 1-Allyl-2,3,4,5-tetramethoxybenzene 1,2,3,4-Tetramethoxy-5-(2)-propenylbenzene 2,3,4,5-Tetramethoxyallylbenzene 6-Methoxyelemicin Benzene, 1-(2-propenyl)-2,3,4,5-tetramethoxy Benzene, 1-allyl-2,3,4,5-tetramethoxy- C13H18O4 238.2796 238.120509064 1,2,3,4-tetramethoxy-5-(prop-2-en-1-yl)benzene 1,2,3,4-tetramethoxy-5-(prop-2-en-1-yl)benzene 15361-99-6 COC1=C(OC)C(OC)=C(OC)C(CC=C)=C1 InChI=1S/C13H18O4/c1-6-7-9-8-10(14-2)12(16-4)13(17-5)11(9)15-3/h6,8H,1,7H2,2-5H3 HRAXJWRHSUTMCS-UHFFFAOYSA-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 benzenetriol logp 2.80 ALOGPS logs -3.42 ALOGPS solubility 8.97e-02 g/l ALOGPS melting_point Mp 25° logp 2.44 ChemAxon pka_strongest_basic -4.3 ChemAxon iupac 1,2,3,4-tetramethoxy-5-(prop-2-en-1-yl)benzene ChemAxon average_mass 238.2796 ChemAxon mono_mass 238.120509064 ChemAxon smiles COC1=C(OC)C(OC)=C(OC)C(CC=C)=C1 ChemAxon formula C13H18O4 ChemAxon inchi InChI=1S/C13H18O4/c1-6-7-9-8-10(14-2)12(16-4)13(17-5)11(9)15-3/h6,8H,1,7H2,2-5H3 ChemAxon inchikey HRAXJWRHSUTMCS-UHFFFAOYSA-N ChemAxon polar_surface_area 36.92 ChemAxon refractivity 66.2 ChemAxon polarizability 25.51 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 4 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 9894 Specdb::CMs 163014 Specdb::MsMs 56922 Specdb::MsMs 56923 Specdb::MsMs 56924 Specdb::MsMs 112458 Specdb::MsMs 112459 Specdb::MsMs 112460 Specdb::MsMs 2791118 Specdb::MsMs 2791119 Specdb::MsMs 2791120 Specdb::MsMs 2914502 Specdb::MsMs 2914503 Specdb::MsMs 2914504 HMDB34046 #<Reference:0x00007f093c078310> Herbs and Spices Unknown generic Parsley Type 1 specific Petroselinum crispum 4043 1330.25 1330.25 1330.25 mg/100 g