{"ymdb_id":"YMDB01588","created_at":"2011-08-31T03:25:21.000Z","updated_at":"2016-09-08T18:36:52.000Z","name":"2-Methylisoborneol","cas":"2371-42-8","state":null,"melting_point":null,"description":"2-Methylisoborneol is a derivate of borneol. Its odor detection threshold is very low and it is one of the chemicals with major influence on the quality of drinking water. 2-Methylisoborneol is also a factor in cork taint in winemaking.","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":"61987","hmdb_id":null,"kegg_id":null,"pubchem_id":"16913","cs_id":"23976421","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"(1S,2R,4R)-1,2,7,7-tetramethylbicyclo[2.2.1]heptan-2-ol","traditional_iupac":"(1S,2R,4R)-1,2,7,7-tetramethylbicyclo[2.2.1]heptan-2-ol","logp":"2.270034552666666","pka":null,"alogps_solubility":"4.50e-01 g/l","alogps_logp":"3.25","alogps_logs":"-2.57","acceptor_count":"1","donor_count":"1","rotatable_bond_count":"0","polar_surface_area":"20.23","refractivity":"49.9525","polarizability":"28.695036838572335","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"-0.42376531955532204","pka_strongest_acidic":null,"bioavailability":"1","number_of_rings":"2","rule_of_five":"1","ghose_filter":"1","veber_rule":"1","mddr_like_rule":"0","synonyms":["(1R-exo)-1,2,7,7-tetramethylbicyclo(2.2.1)heptan-2-ol","exo-1,2,7,7-tetramethylbicyclo(2.2.1)heptan-2-ol","MIB"],"pathways":[],"growth_conditions":[],"references":[],"proteins":[]}