{"ymdb_id":"YMDB01435","created_at":"2011-07-25T20:37:30.000Z","updated_at":"2016-09-08T18:36:40.000Z","name":"5-methyl-2-furancarboxaldehyde","cas":"620-02-0","state":"Solid","melting_point":null,"description":"5-Methyl-furfural is a volatile aroma compound found in yeast extracts. It is responsible for almond aromas.","experimental_water_solubility":null,"experimental_logp_hydrophobicity":"0.67 [SANGSTER (1994)]","location":null,"synthesis_reference":null,"chebi_id":"27594","hmdb_id":null,"kegg_id":"C11115","pubchem_id":"12097","cs_id":"11600","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"5-methylfuran-2-carbaldehyde","traditional_iupac":"5-methylfurfural","logp":"0.9455561276666667","pka":null,"alogps_solubility":"1.49e+01 g/l","alogps_logp":"0.69","alogps_logs":"-0.87","acceptor_count":"1","donor_count":"0","rotatable_bond_count":"1","polar_surface_area":"30.21","refractivity":"30.182600000000004","polarizability":"11.09621260118849","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"-2.9566156259827547","pka_strongest_acidic":null,"bioavailability":"1","number_of_rings":"1","rule_of_five":"1","ghose_filter":"0","veber_rule":"1","mddr_like_rule":"0","synonyms":["2-Formyl-5-methylfuran","2-Furaldehyde, 5-methyl-","2-Methyl-5-formylfuran","5-ethyl-2-furfural","5-methyIfurfural","5-Methyl-2-furaldehyde","5-methyl-2-furanaldehyde","5-Methyl-2-furancarbaldehyde","5-Methyl-2-furancarboxaldehyde (5-methylfurfural)","5-Methyl-2-furancarboxyaldehyde","5-Methyl-2-furfural","5-methylfuran-2-carbaldehyde","5-Methylfurfural","5-Methylfurfuraldehyde","Furfural, 5-methyl-","Methyl-5-furfural"],"pathways":[],"growth_conditions":[],"references":[{"pubmed_id":16968089,"citation":"Mahadevan, K., Farmer, L. (2006). \"Key odor impact compounds in three yeast extract pastes.\" J Agric Food Chem 54:7242-7250."}],"proteins":[]}