{"ymdb_id":"YMDB01684","created_at":"2011-08-31T03:35:30.000Z","updated_at":"2016-09-08T18:36:59.000Z","name":"Ethyl formate","cas":"109-94-4","state":"Liquid","melting_point":"-79.6 oC","description":"Ethyl formate is an ester formed from ethanol and formic acid. Ethyl formate has the characteristic smell of rum. It is responsible for raspberry, strawberry and black currant aromas.","experimental_water_solubility":"88.2 mg/mL at 25 oC [HANSCH,C et al. (1968)]","experimental_logp_hydrophobicity":"0.23 [HANSCH,C ET AL. (1995)]","location":null,"synthesis_reference":null,"chebi_id":"15740","hmdb_id":null,"kegg_id":null,"pubchem_id":"8025","cs_id":"7734","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"ethyl formate","traditional_iupac":"ethyl formate","logp":"0.23065758833333322","pka":null,"alogps_solubility":"3.05e+02 g/l","alogps_logp":"0.38","alogps_logs":"0.61","acceptor_count":"1","donor_count":"0","rotatable_bond_count":"2","polar_surface_area":"26.3","refractivity":"17.670900000000003","polarizability":"7.320130895070666","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"-6.815865490869983","pka_strongest_acidic":null,"bioavailability":"1","number_of_rings":"0","rule_of_five":"1","ghose_filter":"0","veber_rule":"1","mddr_like_rule":"0","synonyms":["Aethylformiat","aminate","Areginal","Ethyl ester of formic acid","Ethyl formic ester","Ethyl methanoate","Ethyle","Ethyle(formiate d')","Ethylester kyseliny mravenci","Ethylformiaat","Ethylformic ester","Etile","Etile(formiato di)","Formic acid, ethyl ester","formic acid, ion(1-)","Formic ether","formylate","HCO2 anion","HCOOC2H5","hydrogen carboxylate","methanoate","Mrowczan etylu"],"pathways":[],"growth_conditions":[],"references":[],"proteins":[]}