1.0 2010-04-08 22:09:08 UTC 2018-05-28 23:28:04 UTC FDB010449 Vanillin 3-(L-menthoxy)propane-1,2-diol acetal It is used as a food additive . 2-Methoxy-4-[4-[[[5-methyl-2-(1-methylethyl)cyclohexyl]oxy]methyl]-1,3-dioxolan-2-yl]-phenol Phenol, 2-methoxy-4-[4-[[[5-methyl-2-(1-methylethyl)cyclohexyl]oxy]methyl]-1,3-dioxolan-2-yl]- C21H32O5 364.4758 364.224974134 2-methoxy-4-[4-({[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}methyl)-1,3-dioxolan-2-yl]phenol 4-(4-{[(2-isopropyl-5-methylcyclohexyl)oxy]methyl}-1,3-dioxolan-2-yl)-2-methoxyphenol 180964-47-0 COC1=C(O)C=CC(=C1)C1OCC(COC2CC(C)CCC2C(C)C)O1 InChI=1S/C21H32O5/c1-13(2)17-7-5-14(3)9-19(17)24-11-16-12-25-21(26-16)15-6-8-18(22)20(10-15)23-4/h6,8,10,13-14,16-17,19,21-22H,5,7,9,11-12H2,1-4H3 ZOGKSXQLOOQXFG-UHFFFAOYSA-N belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic ring. Aromatic monoterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Monoterpenoids Aromatic heteromonocyclic compounds 1,3-dioxolanes 1-hydroxy-2-unsubstituted benzenoids Acetals Alkyl aryl ethers Anisoles Dialkyl ethers Hydrocarbon derivatives Menthane monoterpenoids Methoxybenzenes Methoxyphenols Monocyclic monoterpenoids Oxacyclic compounds Phenoxy compounds 1-hydroxy-2-unsubstituted benzenoid Acetal Alkyl aryl ether Anisole Aromatic heteromonocyclic compound Aromatic monoterpenoid Benzenoid Dialkyl ether Ether Hydrocarbon derivative Meta-dioxolane Methoxybenzene Methoxyphenol Monocyclic benzene moiety Monocyclic monoterpenoid Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle P-menthane monoterpenoid Phenol Phenol ether Phenoxy compound logp 4.18 ALOGPS logs -4.59 ALOGPS solubility 9.44e-03 g/l ALOGPS logp 4.69 ChemAxon pka_strongest_acidic 9.88 ChemAxon pka_strongest_basic -3.8 ChemAxon iupac 2-methoxy-4-[4-({[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}methyl)-1,3-dioxolan-2-yl]phenol ChemAxon average_mass 364.4758 ChemAxon mono_mass 364.224974134 ChemAxon smiles COC1=C(O)C=CC(=C1)C1OCC(COC2CC(C)CCC2C(C)C)O1 ChemAxon formula C21H32O5 ChemAxon inchi InChI=1S/C21H32O5/c1-13(2)17-7-5-14(3)9-19(17)24-11-16-12-25-21(26-16)15-6-8-18(22)20(10-15)23-4/h6,8,10,13-14,16-17,19,21-22H,5,7,9,11-12H2,1-4H3 ChemAxon inchikey ZOGKSXQLOOQXFG-UHFFFAOYSA-N ChemAxon polar_surface_area 57.15 ChemAxon refractivity 99.78 ChemAxon polarizability 41.87 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 5 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 17380 Specdb::CMs 42847 Specdb::CMs 164063 Specdb::MsMs 304411 Specdb::MsMs 304412 Specdb::MsMs 304413 Specdb::MsMs 347608 Specdb::MsMs 347609 Specdb::MsMs 347610 Specdb::MsMs 2322484 Specdb::MsMs 2322485 Specdb::MsMs 2322486 Specdb::MsMs 2615721 Specdb::MsMs 2615722 Specdb::MsMs 2615723 HMDB32553 #<Reference:0x000055ce3250d178> minty vanilla