{"ymdb_id":"YMDB01708","created_at":"2011-08-31T03:38:23.000Z","updated_at":"2016-09-08T18:37:01.000Z","name":"Hexan-2,3-dione","cas":null,"state":null,"melting_point":null,"description":"Hexan-2,3-dione is a compound responsible for cheesy aromas.","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":"18563","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"hexane-2,3-dione","traditional_iupac":"2,3-hexanedione","logp":"1.5406039879999998","pka":null,"alogps_solubility":"1.97e+01 g/l","alogps_logp":"0.80","alogps_logs":"-0.76","acceptor_count":"2","donor_count":"0","rotatable_bond_count":"3","polar_surface_area":"34.14","refractivity":"30.7687","polarizability":"12.211166776100857","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"-8.386186344193897","pka_strongest_acidic":"16.23289723772394","bioavailability":"1","number_of_rings":"0","rule_of_five":"1","ghose_filter":"0","veber_rule":"1","mddr_like_rule":"0","synonyms":["2,3-Hexandione","2,3-Hexanodione","Acetyl butyryl","Acetylbutyryl","Butyryl acetyl","FEMA 2558","Methyl propyl diketone","Methyl propyl glyoxal"],"pathways":[],"growth_conditions":[],"references":[],"proteins":[]}