1.02010-04-08 22:08:00 UTC2019-11-26 03:02:23 UTCFDB0082832-Propene-1-thiolComponent of onion flavour (Allium cepa) and other Allium subspecies Flavouring ingredient. Potential nutriceutical. 2-Propene-1-thiol is found in many foods, some of which are onion-family vegetables, soft-necked garlic, garden onion, and chives.2-propenyl mercaptan2-Propenyl-1-thiol3-MercaptopropeneAllyl mercaptanAllyl sulfhydrateAllyl thioalcoholAllylthiolCH2=CHCH2SHFEMA 2035C3H6S74.14574.019020882prop-2-ene-1-thiolallyl mercaptan870-23-5SCC=CInChI=1S/C3H6S/c1-2-3-4/h2,4H,1,3H2ULIKDJVNUXNQHS-UHFFFAOYSA-N belongs to the class of organic compounds known as allyl sulfur compounds. Allyl sulfur compounds are compounds containing an allylsulfur group, with the general structure H2C(=CH2)CS.Allyl sulfur compoundsOrganic compoundsOrganosulfur compoundsAllyl sulfur compoundsAliphatic acyclic compoundsAlkylthiolsHydrocarbon derivativesAliphatic acyclic compoundAlkylthiolAllyl sulfur compoundHydrocarbon derivativelogp1.42logs-1.27solubility3.94e+00 g/llogp1.46pka_strongest_acidic10pka_strongest_basic-9.7iupacprop-2-ene-1-thiolaverage_mass74.145mono_mass74.019020882smilesSCC=CformulaC3H6SinchiInChI=1S/C3H6S/c1-2-3-4/h2,4H,1,3H2inchikeyULIKDJVNUXNQHS-UHFFFAOYSA-Npolar_surface_area0refractivity23.45polarizability8.36rotatable_bond_count1acceptor_count0donor_count1physiological_charge0formal_charge0Specdb::MsIr4770Specdb::MsIr4771Specdb::MsIr4772Specdb::CMs24919Specdb::CMs146288Specdb::NmrOneD165069Specdb::NmrOneD165070Specdb::NmrOneD165071Specdb::NmrOneD165072Specdb::NmrOneD165073Specdb::NmrOneD165074Specdb::NmrOneD165075Specdb::NmrOneD165076Specdb::NmrOneD165077Specdb::NmrOneD165078Specdb::NmrOneD165079Specdb::NmrOneD165080Specdb::NmrOneD165081Specdb::NmrOneD165082Specdb::NmrOneD165083Specdb::NmrOneD165084Specdb::NmrOneD165085Specdb::NmrOneD165086Specdb::NmrOneD165087Specdb::NmrOneD165088Specdb::MsMs9947Specdb::MsMs9948Specdb::MsMs9949Specdb::MsMs16619Specdb::MsMs16620Specdb::MsMs16621Specdb::MsMs2278652Specdb::MsMs2278653Specdb::MsMs2278654Specdb::MsMs3089602Specdb::MsMs3089603Specdb::MsMs3089604HMDB31635#<Reference:0x000055567623f218>ChivesType 1specificAllium schoenoprasum74900Garden onionType 1specificAllium cepa4679Garden onion (var.)Type 1specificAllium cepa var. cepa4679Green onionType 1Onion-family vegetablesUnknowngenericRed onionType 1Soft-necked garlicType 1specificAllium sativum L. var. sativum4682Welsh onionType 1specificAllium fistulosum35875alliaceousgarliconionroastedsulfurousacantholytic15anti giardial296anti staphylococcic627A substance that kills or slows the growth of bacteria.antioxidant502A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides. In European countries, E-numbers for permitted antioxidant food additives are from E 300 to E 324.irritant1055pemphigenic1203protisticide1266spice1324