{"ymdb_id":"YMDB01458","created_at":"2011-07-25T20:40:20.000Z","updated_at":"2016-09-08T18:36:42.000Z","name":"2-methylpyridine","cas":"109-06-8","state":"Liquid","melting_point":"-66.7 oC","description":"2-Methylpyridine, or 2-picoline, is the compound described with formula C6H7N. 2-picoline is a colorless liquid that has an unpleasant odor similar to pyridine. Pyridines including 2-picoline are most crudely prepared by the reaction of acetylene and hydrogen cyanide. [Wikipedia]","experimental_water_solubility":"1000 mg/mL [RIDDICK,JA et al. (1986)]","experimental_logp_hydrophobicity":"1.11 [HANSCH,C ET AL. (1995)]","location":null,"synthesis_reference":null,"chebi_id":"50415","hmdb_id":null,"kegg_id":"C01270","pubchem_id":"7975","cs_id":"13839199","foodb_id":null,"wikipedia_link":"2-methylpyridine","biocyc_id":null,"iupac":"2-methylpyridine","traditional_iupac":"α-methylpyridine","logp":"0.8869435579999998","pka":null,"alogps_solubility":"2.02e+02 g/l","alogps_logp":"1.25","alogps_logs":"0.34","acceptor_count":"1","donor_count":"0","rotatable_bond_count":"0","polar_surface_area":"12.89","refractivity":"28.492599999999996","polarizability":"10.384814328327693","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"5.8116853236678585","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-Mepy","2-Methylpyridine","2-Picoline","3-Hydroxy-2-methylpyridine-5-carboxylate","alpha-Methylpyridine","alpha-Picoline","o-Methylpyridine","o-Picoline","Picoline","PICOLINE, alpha","Pyridine, 2-methyl-"],"pathways":[{"name":"Vitamin B6 metabolism","kegg_map_id":"00750"}],"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":[]}