{"ymdb_id":"YMDB01791","created_at":"2011-08-31T03:45:59.000Z","updated_at":"2016-09-08T18:37:08.000Z","name":"Terpinyl acetate","cas":"80-26-2","state":null,"melting_point":null,"description":"Terpinyl acetate is a terpene found in wine. Terpinyl acetate has an odor which is described as herbal, citrus, spicy, woody, floral, waxy and clean. It is a colorless clear liquid which is abundant in spices like cardamon.","experimental_water_solubility":null,"experimental_logp_hydrophobicity":"3.96 [GRIFFIN,S ET AL. (1999)]","location":null,"synthesis_reference":null,"chebi_id":null,"hmdb_id":null,"kegg_id":"C12300","pubchem_id":"93317","cs_id":"99681","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"2-(4-methylcyclohex-3-en-1-yl)propan-2-yl acetate","traditional_iupac":"α-terpinyl acetate","logp":"2.615422917999999","pka":null,"alogps_solubility":"1.42e-01 g/l","alogps_logp":"4.32","alogps_logs":"-3.14","acceptor_count":"1","donor_count":"0","rotatable_bond_count":"3","polar_surface_area":"26.3","refractivity":"57.6134","polarizability":"23.04911640477613","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"-7.010767657855061","pka_strongest_acidic":null,"bioavailability":"1","number_of_rings":"1","rule_of_five":"1","ghose_filter":"1","veber_rule":"1","mddr_like_rule":"0","synonyms":["|A-terpineol acetate","1-Methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl acetate","ACETATE ION","acetic acid, ion(1-)","alpha-Terpineol acetate","alpha-Terpinyl acetate","Azetat","Ethanoat","ethanoate","MeCO2 anion","p-Menth-1-en-8-ol, acetate","p-menth-1-en-8-yl acetate"],"pathways":[],"growth_conditions":[],"references":[{"pubmed_id":17616208,"citation":"Loscos, N., Hernandez-Orte, P., Cacho, J., Ferreira, V. (2007). \"Release and formation of varietal aroma compounds during alcoholic fermentation from nonfloral grape odorless flavor precursors fractions.\" J Agric Food Chem 55:6674-6684."}],"proteins":[]}