1.02010-04-08 22:14:43 UTC2015-07-21 06:41:02 UTCFDB019971Butyl lactateFlavouring agent2-Hydroxy-butyl ester(2S)-propanoic acid2-Hydroxypropanoic acid butyl esterButyl (S)-2-hydroxypropionateButyl α-hydroxypropionateButyl 2-hydroxypropanoateButyl alpha -hydroxypropionateButyl alpha-hydroxypropionateButyl l-lactateButyl lactateButylester kyseliny mlecneFEMA 2205Lactic acid n-butyl esterLactic acid, butyl esterN-butyl lactatePropanoic acid, 2-hydroxy-, butyl esterPropanoic acid, 2-hydroxy-, butyl ester, (2S)-C7H14O3146.1843146.094294314butyl 2-hydroxypropanoatebutyl lactate138-22-7CCCCOC(=O)C(C)OInChI=1S/C7H14O3/c1-3-4-5-10-7(9)6(2)8/h6,8H,3-5H2,1-2H3MRABAEUHTLLEML-UHFFFAOYSA-N belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group).Carboxylic acid estersOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesCarboxylic acid derivativesAliphatic acyclic compoundsCarbonyl compoundsHydrocarbon derivativesMonocarboxylic acids and derivativesOrganic oxidesSecondary alcoholsAlcoholAliphatic acyclic compoundCarbonyl groupCarboxylic acid esterHydrocarbon derivativeMonocarboxylic acid or derivativesOrganic oxideOrganic oxygen compoundOrganooxygen compoundSecondary alcoholLiquidlogp0.63logs-0.48solubility4.84e+01 g/lmelting_point-28 oClogp1pka_strongest_acidic13pka_strongest_basic-3.7iupacbutyl 2-hydroxypropanoateaverage_mass146.1843mono_mass146.094294314smilesCCCCOC(=O)C(C)OformulaC7H14O3inchiInChI=1S/C7H14O3/c1-3-4-5-10-7(9)6(2)8/h6,8H,3-5H2,1-2H3inchikeyMRABAEUHTLLEML-UHFFFAOYSA-Npolar_surface_area46.53refractivity37.48polarizability16.25rotatable_bond_count5acceptor_count2donor_count1physiological_charge0formal_charge0Specdb::EiMs1224Specdb::MsIr8850Specdb::MsIr8851Specdb::MsIr8852Specdb::CMs20278Specdb::CMs27148Specdb::CMs27495Specdb::CMs29491Specdb::CMs29729Specdb::CMs29737Specdb::CMs46716Specdb::CMs102101Specdb::CMs102102Specdb::CMs102103Specdb::CMs102104Specdb::CMs102105Specdb::CMs165406Specdb::NmrOneD2237Specdb::NmrOneD2932Specdb::NmrOneD39342Specdb::NmrOneD39343Specdb::NmrOneD39344Specdb::NmrOneD39345Specdb::NmrOneD39346Specdb::NmrOneD39347Specdb::NmrOneD39348Specdb::NmrOneD39349Specdb::NmrOneD39350Specdb::NmrOneD39351Specdb::NmrOneD39352Specdb::NmrOneD39353Specdb::NmrOneD39354Specdb::NmrOneD39355Specdb::NmrOneD39356Specdb::NmrOneD39357Specdb::NmrOneD39358Specdb::NmrOneD39359Specdb::NmrOneD39360Specdb::NmrOneD39361Specdb::MsMs108507Specdb::MsMs108508Specdb::MsMs108509Specdb::MsMs175746Specdb::MsMs175747Specdb::MsMs175748Specdb::MsMs2750002Specdb::MsMs2750003Specdb::MsMs2750004Specdb::MsMs2928910Specdb::MsMs2928911Specdb::MsMs2928912HMDB40254#<Reference:0x0000555675ebb538>creamyfermentedfruitymushroomwaxy