1.02010-04-08 22:08:00 UTC2015-07-20 22:20:35 UTCFDB008287Pentyl propanoateFlavouring ingredient
Pentyl propanoate is an organic compound which is the ester formed by the condensation of pentanol and propanoic acid. It is also known as apricot essence.Amyl propanoateAmyl propionateN-amyl n-propionateN-amyl propionateN-pentyl propanoateN-pentyl propionatePentyl propanatePentyl propanoatePentyl propionatePropanoic acid, pentyl esterPropionic acid, pentyl esterPropionic acid, pentyl ester (6CI,7CI,8CI)C8H16O2144.2114144.115029756pentyl propanoateamyl propionate624-54-4CCCCCOC(=O)CCInChI=1S/C8H16O2/c1-3-5-6-7-10-8(9)4-2/h3-7H2,1-2H3TWSRVQVEYJNFKQ-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 oxidesAliphatic acyclic compoundCarbonyl groupCarboxylic acid esterHydrocarbon derivativeMonocarboxylic acid or derivativesOrganic oxideOrganic oxygen compoundOrganooxygen compoundpropanoate esterlogp2.93logs-2.16solubility1.00e+00 g/lmelting_pointFp -73.1°logp2.39pka_strongest_basic-7iupacpentyl propanoateaverage_mass144.2114mono_mass144.115029756smilesCCCCCOC(=O)CCformulaC8H16O2inchiInChI=1S/C8H16O2/c1-3-5-6-7-10-8(9)4-2/h3-7H2,1-2H3inchikeyTWSRVQVEYJNFKQ-UHFFFAOYSA-Npolar_surface_area26.3refractivity40.51polarizability17.51rotatable_bond_count6acceptor_count1donor_count0physiological_charge0formal_charge0Specdb::MsIr4776Specdb::MsIr4777Specdb::CMs3442Specdb::CMs28287Specdb::CMs100902Specdb::CMs174102Specdb::NmrOneD305931Specdb::NmrOneD305932Specdb::NmrOneD305933Specdb::NmrOneD305934Specdb::NmrOneD305935Specdb::NmrOneD305936Specdb::NmrOneD305937Specdb::NmrOneD305938Specdb::NmrOneD305939Specdb::NmrOneD305940Specdb::NmrOneD305941Specdb::NmrOneD305942Specdb::NmrOneD305943Specdb::NmrOneD305944Specdb::NmrOneD305945Specdb::NmrOneD305946Specdb::NmrOneD305947Specdb::NmrOneD305948Specdb::NmrOneD305949Specdb::NmrOneD305950Specdb::MsMs59652Specdb::MsMs59653Specdb::MsMs59654Specdb::MsMs115839Specdb::MsMs115840Specdb::MsMs115841Specdb::MsMs2325888Specdb::MsMs2325889Specdb::MsMs2325890Specdb::MsMs2612272Specdb::MsMs2612273Specdb::MsMs2612274HMDB31638#<Reference:0x0000555675dd6d20>apricotfruitypineapplesweet