{"ymdb_id":"YMDB15971","created_at":"2016-08-03T23:50:03.000Z","updated_at":"2016-09-10T00:52:21.000Z","name":"Butylated hydroxytoluene","cas":null,"state":null,"melting_point":null,"description":"Butylated hydroxytoluene, or 2,6-di-tert-butyl-4-methylphenol is found in soft-necked garlic. Antioxidant, used in cosmetics, foods and pharmaceuticals.Butylated hydroxytoluene (BHT), also known as butylhydroxytoluene, is a lipophilic (fat-soluble) organic compound that is primarily used as an antioxidant food additive (E number E321) as well as an antioxidant additive in cosmetics, pharmaceuticals, jet fuels, rubber, petroleum products, electrical transformer oil, and embalming fluid. (Wikipedia).","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":null,"hmdb_id":null,"kegg_id":null,"pubchem_id":null,"cs_id":null,"foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"2,6-di-tert-butyl-4-methylphenol","traditional_iupac":"ional","logp":"5.273214425000001","pka":null,"alogps_solubility":"1.52e-02 g/l","alogps_logp":"5.25","alogps_logs":"-4.16","acceptor_count":"1","donor_count":"1","rotatable_bond_count":"2","polar_surface_area":"20.23","refractivity":"70.41189999999999","polarizability":"27.348201983235235","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"-4.559361293068014","pka_strongest_acidic":"11.602391152527046","bioavailability":"1","number_of_rings":"1","rule_of_five":"0","ghose_filter":"1","veber_rule":"1","mddr_like_rule":"0","synonyms":[],"pathways":[],"growth_conditions":[],"references":[{"pubmed_id":19845354,"citation":"Robinson AL, Ebeler SE, Heymann H, Boss PK, Solomon PS, Trengove RD. (2009). \"Interactions between wine volatile compounds and grape and wine matrix components influence aroma compound headspace partitioning.\" J Agric Food Chem. 2009 Nov 11;57(21):10313-22."}],"proteins":[]}