1.02010-04-08 22:09:54 UTC2019-11-26 03:05:46 UTCFDB0119313-Methyl-2-butanol3-Methyl-2-butanol is a flavouring ingredient. It is found in apple, cider, grape, honey, wine, orange juice and strawberry.(+)-3-Methyl-2-butanol(CH3)2CHCH(OH)CH3(S)-(+)-3-Methyl-2-butanol1,2-Dimethyl-1-propanol1,2-Dimethylpropanol2-Butanol, 3-methyl-2-Butanol, 3-methyl-, (S)-2-Methyl-3-butanol3-Methyl butan-2-ol3-Methyl-(S)-2-butanol3-Methyl-butan-2-ol3-Methylbutan-2-olButan-2-ol, 3-methyl-DL-3-Methyl-2-butanolFEMA 3703Isopropyl methyl carbinolIsopropylmethylcarbinolMethylisopropylcarbinolsec-Isoamyl alcoholC5H12O88.148288.0888150063-methylbutan-2-ol3-methyl-2-butanol598-75-4CC(C)C(C)OInChI=1S/C5H12O/c1-4(2)5(3)6/h4-6H,1-3H3MXLMTQWGSQIYOW-UHFFFAOYSA-N belongs to the class of organic compounds known as secondary alcohols. Secondary alcohols are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl).Secondary alcoholsOrganic compoundsOrganic oxygen compoundsOrganooxygen compoundsAlcohols and polyolsAliphatic acyclic compoundsHydrocarbon derivativesAliphatic acyclic compoundHydrocarbon derivativeSecondary alcoholsecondary alcohollogp0.89logs-0.11solubility6.92e+01 g/llogp1.14pka_strongest_acidic18.18pka_strongest_basic-1.4iupac3-methylbutan-2-olaverage_mass88.1482mono_mass88.088815006smilesCC(C)C(C)OformulaC5H12OinchiInChI=1S/C5H12O/c1-4(2)5(3)6/h4-6H,1-3H3inchikeyMXLMTQWGSQIYOW-UHFFFAOYSA-Npolar_surface_area20.23refractivity26.42polarizability10.9rotatable_bond_count1acceptor_count1donor_count1physiological_charge0formal_charge0Specdb::MsIr6259Specdb::MsIr6260Specdb::MsIr6261Specdb::MsMs97929Specdb::MsMs97930Specdb::MsMs97931Specdb::MsMs162738Specdb::MsMs162739Specdb::MsMs162740Specdb::MsMs2447676Specdb::MsMs2447677Specdb::MsMs2447678Specdb::MsMs2517519Specdb::MsMs2517520Specdb::MsMs2517521Specdb::CMs2493Specdb::CMs27146Specdb::CMs43498Specdb::CMs101400Specdb::CMs131851Specdb::CMs139585Specdb::NmrOneD4500Specdb::NmrOneD4626Specdb::NmrOneD122178Specdb::NmrOneD122179Specdb::NmrOneD122180Specdb::NmrOneD122181Specdb::NmrOneD122182Specdb::NmrOneD122183Specdb::NmrOneD122184Specdb::NmrOneD122185Specdb::NmrOneD122186Specdb::NmrOneD122187Specdb::NmrOneD122188Specdb::NmrOneD122189Specdb::NmrOneD122190Specdb::NmrOneD122191Specdb::NmrOneD122192Specdb::NmrOneD122193Specdb::NmrOneD122194Specdb::NmrOneD122195Specdb::NmrOneD122196Specdb::NmrOneD122197HMDB33777#<Reference:0x00005556760c5e78>Alcoholic beveragesUnknowngenericBeerType 2specific21.5321.5321.53mg/100 gCitrusUnknowngenericFruitsUnknowngenericPomesUnknowngenericfruity