1.0 2010-04-08 22:04:44 UTC 2019-11-26 02:55:33 UTC FDB000865 2,6-Dimethoxy-4-methylphenol Present in smoked fish and pork. Flavouring ingredient. 2,6-Dimethoxy-4-methylphenol is found in fishes and animal foods. 2,6-Dimethoxy-4-methyl-phenol 2,6-Dimethoxy-4-methylphenol, 9CI 2,6-Dimethoxy-p-cresol 4-methyl-2,6-dimethoxyphenol 4-Methyl-2,6-dimethoxyphenol (4-methylsyringol) 4-Methylsyringol FEMA 3704 Phenol, 2,6-dimethoxy-4-methyl- Phenol, 4-methyl-2,6-dimethoxy Syringol, 4-methyl C9H12O3 168.1898 168.07864425 2,6-dimethoxy-4-methylphenol 2,6-dimethoxy-4-methylphenol 6638-05-7 COC1=CC(C)=CC(OC)=C1O InChI=1S/C9H12O3/c1-6-4-7(11-2)9(10)8(5-6)12-3/h4-5,10H,1-3H3 ZFBNNSOJNZBLLS-UHFFFAOYSA-N belongs to the class of organic compounds known as methoxyphenols. Methoxyphenols are compounds containing a methoxy group attached to the benzene ring of a phenol moiety. Methoxyphenols Organic compounds Benzenoids Phenols Methoxyphenols Aromatic homomonocyclic compounds Alkyl aryl ethers Anisoles Dimethoxybenzenes Hydrocarbon derivatives Para cresols Phenoxy compounds Toluenes Alkyl aryl ether Anisole Aromatic homomonocyclic compound Dimethoxybenzene Ether Hydrocarbon derivative M-dimethoxybenzene Methoxybenzene Methoxyphenol Monocyclic benzene moiety Organic oxygen compound Organooxygen compound P-cresol Phenol ether Phenoxy compound Toluene Solid logp 1.71 ALOGPS logs -1.60 ALOGPS solubility 4.22e+00 g/l ALOGPS melting_point Mp 36° logp 1.87 ChemAxon pka_strongest_acidic 9.75 ChemAxon pka_strongest_basic -4.6 ChemAxon iupac 2,6-dimethoxy-4-methylphenol ChemAxon average_mass 168.1898 ChemAxon mono_mass 168.07864425 ChemAxon smiles COC1=CC(C)=CC(OC)=C1O ChemAxon formula C9H12O3 ChemAxon inchi InChI=1S/C9H12O3/c1-6-4-7(11-2)9(10)8(5-6)12-3/h4-5,10H,1-3H3 ChemAxon inchikey ZFBNNSOJNZBLLS-UHFFFAOYSA-N ChemAxon polar_surface_area 38.69 ChemAxon refractivity 46.01 ChemAxon polarizability 17.74 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 15011 Specdb::CMs 41514 Specdb::CMs 172017 Specdb::MsIr 3583 Specdb::MsIr 3584 Specdb::MsIr 3585 Specdb::NmrOneD 109958 Specdb::NmrOneD 109959 Specdb::NmrOneD 109960 Specdb::NmrOneD 109961 Specdb::NmrOneD 109962 Specdb::NmrOneD 109963 Specdb::NmrOneD 109964 Specdb::NmrOneD 109965 Specdb::NmrOneD 109966 Specdb::NmrOneD 109967 Specdb::NmrOneD 109968 Specdb::NmrOneD 109969 Specdb::NmrOneD 109970 Specdb::NmrOneD 109971 Specdb::NmrOneD 109972 Specdb::NmrOneD 109973 Specdb::NmrOneD 109974 Specdb::NmrOneD 109975 Specdb::NmrOneD 109976 Specdb::NmrOneD 109977 Specdb::MsMs 101487 Specdb::MsMs 101488 Specdb::MsMs 101489 Specdb::MsMs 167121 Specdb::MsMs 167122 Specdb::MsMs 167123 Specdb::MsMs 2272647 Specdb::MsMs 2272648 Specdb::MsMs 2272649 Specdb::MsMs 3070206 Specdb::MsMs 3070207 Specdb::MsMs 3070208 HMDB29680 #<Reference:0x000055ce33471150> Fishes Unknown generic caramel eugenol medicinal phenolic root smoke spice woody