1.0 2010-04-08 22:05:53 UTC 2025-11-18 22:53:18 UTC FDB003639 Methyl-1-propenyl trisulfide Methyl-1-propenyl trisulfide is a member of the class of compounds known as organic trisulfides. Organic trisulfides are organosulfur compounds with the general formula RSSSR' (R,R'=alkyl, aryl). Methyl-1-propenyl trisulfide can be found in soft-necked garlic, which makes methyl-1-propenyl trisulfide a potential biomarker for the consumption of this food product. Trisulfide, methyl 1-propenyl C4H8S3 152.29 151.97881378 1-methyl-3-(prop-1-en-1-yl)trisulfane 1-methyl-3-(prop-1-en-1-yl)trisulfane CSSSC=CC InChI=1S/C4H8S3/c1-3-4-6-7-5-2/h3-4H,1-2H3 WPRUFZZPIFLBDG-UHFFFAOYSA-N belongs to the class of organic compounds known as organic trisulfides. These are organosulfur compounds with the general formula RSSSR' (R,R'=alkyl, aryl). Organic trisulfides Organic compounds Organosulfur compounds Organic trisulfides Aliphatic acyclic compounds Hydrocarbon derivatives Sulfenyl compounds Aliphatic acyclic compound Hydrocarbon derivative Organic trisulfide Sulfenyl compound logp 2.44 ALOGPS logs -2.48 ALOGPS solubility 5.07e-01 g/l ALOGPS logp 2.68 ChemAxon iupac 1-methyl-3-(prop-1-en-1-yl)trisulfane ChemAxon average_mass 152.29 ChemAxon mono_mass 151.97881378 ChemAxon smiles CSSSC=CC ChemAxon formula C4H8S3 ChemAxon inchi InChI=1S/C4H8S3/c1-3-4-6-7-5-2/h3-4H,1-2H3 ChemAxon inchikey WPRUFZZPIFLBDG-UHFFFAOYSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 42.28 ChemAxon polarizability 15.45 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 87543 Specdb::MsMs 87544 Specdb::MsMs 87545 Specdb::MsMs 150063 Specdb::MsMs 150064 Specdb::MsMs 150065 Specdb::MsMs 3599303 Specdb::MsMs 3599304 Specdb::MsMs 3599305 Specdb::MsMs 3599306 Specdb::MsMs 3599307 Specdb::MsMs 3599308 Soft-necked garlic Type 1 specific Allium sativum L. var. sativum 4682