1.0 2010-04-08 22:14:42 UTC 2019-11-26 03:18:10 UTC FDB019959 1-Propenyl propyl sulfide Volatile constituent of Welsh onion, scallions, leek, garlic and shallots. Usually present as a mixture of (E)- and (Z)-isomers. 1-Propenyl propyl sulfide is found in onion-family vegetables. (1E)-1-(Propylsulfanyl)-1-propene 1-(Propylthio)-1-propene, 9CI 4-Thia-2-heptene C6H12S 116.224 116.065971074 (1E)-1-(propylsulfanyl)prop-1-ene (1E)-1-(propylsulfanyl)prop-1-ene 33922-70-2 CCCS\C=C\C InChI=1S/C6H12S/c1-3-5-7-6-4-2/h3,5H,4,6H2,1-2H3/b5-3+ RKVNNVDQIVWRNA-HWKANZROSA-N belongs to the class of organic compounds known as thioenol ethers. Thioenol ethers are compounds containing the enol ether functional group, with the formula R3SCR2=CR1. Thioenol ethers Organic compounds Organosulfur compounds Thioethers Thioenol ethers Aliphatic acyclic compounds Hydrocarbon derivatives Sulfenyl compounds Aliphatic acyclic compound Hydrocarbon derivative Sulfenyl compound Thioenolether logp 3.36 ALOGPS logs -2.61 ALOGPS solubility 2.82e-01 g/l ALOGPS logp 2.5 ChemAxon iupac (1E)-1-(propylsulfanyl)prop-1-ene ChemAxon average_mass 116.224 ChemAxon mono_mass 116.065971074 ChemAxon smiles CCCS\C=C\C ChemAxon formula C6H12S ChemAxon inchi InChI=1S/C6H12S/c1-3-5-7-6-4-2/h3,5H,4,6H2,1-2H3/b5-3+ ChemAxon inchikey RKVNNVDQIVWRNA-HWKANZROSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 37.82 ChemAxon polarizability 14.47 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 24735 Specdb::CMs 157679 Specdb::MsIr 8833 Specdb::MsIr 8834 Specdb::MsMs 320758 Specdb::MsMs 320759 Specdb::MsMs 320760 Specdb::MsMs 368209 Specdb::MsMs 368210 Specdb::MsMs 368211 Specdb::MsMs 2343962 Specdb::MsMs 2343963 Specdb::MsMs 2343964 Specdb::MsMs 2595493 Specdb::MsMs 2595494 Specdb::MsMs 2595495 HMDB40244 #<Reference:0x000055ce3331f1f8> Garden onion Type 1 specific Allium cepa 4679 Garden onion (var.) Type 1 specific Allium cepa var. cepa 4679 Green onion Type 1 Onion-family vegetables Unknown generic Red onion Type 1 Welsh onion Type 1 specific Allium fistulosum 35875