1.0 2010-04-08 22:15:37 UTC 2019-11-26 03:20:13 UTC FDB021321 Methyl 2-propenyl disulfide Constituent of the essential oils of Allium subspecies Flavouring ingredient. Methyl 2-propenyl disulfide is found in many foods, some of which are garden onion, allium (onion), chives, and soft-necked garlic. 2-propenylmethyldisulfide 3-(Methyldisulfanyl)-1-propene 3-(methyldisulfanyl)prop-1-ene 3-(Methyldisulphanyl)-1-propene 3-(methyldithio)prop-1-ene 4,5-Dithia-1-hexene Allyl methyl disulfide Allyl methyl disulphide Disulfide, allyl methyl Disulfide, methyl 2-propenyl FEMA 3127 Methyl 2-propenyl disulphide Methyl allyl disulfide Methyl allyl disulphide Methylallyl disulfide Methylallyl disulphide C4H8S2 120.236 120.006741636 3-(methyldisulfanyl)prop-1-ene allyl methyl disulfide 2179-58-0 CSSCC=C InChI=1S/C4H8S2/c1-3-4-6-5-2/h3H,1,4H2,2H3 XNZOTQPMYMCTBZ-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 compounds Organic compounds Organosulfur compounds Allyl sulfur compounds Aliphatic acyclic compounds Dialkyldisulfides Hydrocarbon derivatives Sulfenyl compounds Aliphatic acyclic compound Allyl sulfur compound Dialkyldisulfide Hydrocarbon derivative Organic disulfide Sulfenyl compound organic disulfide logp 1.82 ALOGPS logs -2.26 ALOGPS solubility 6.62e-01 g/l ALOGPS logp 2.06 ChemAxon iupac 3-(methyldisulfanyl)prop-1-ene ChemAxon average_mass 120.236 ChemAxon mono_mass 120.006741636 ChemAxon smiles CSSCC=C ChemAxon formula C4H8S2 ChemAxon inchi InChI=1S/C4H8S2/c1-3-4-6-5-2/h3H,1,4H2,2H3 ChemAxon inchikey XNZOTQPMYMCTBZ-UHFFFAOYSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 36.28 ChemAxon polarizability 13 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::EiMs 1854 Specdb::CMs 5901 Specdb::CMs 26897 Specdb::CMs 102203 Specdb::CMs 133485 Specdb::CMs 141219 Specdb::MsIr 9207 Specdb::MsIr 9208 Specdb::MsMs 102711 Specdb::MsMs 102712 Specdb::MsMs 102713 Specdb::MsMs 168579 Specdb::MsMs 168580 Specdb::MsMs 168581 Specdb::MsMs 2700997 Specdb::MsMs 2700998 Specdb::MsMs 2700999 Specdb::MsMs 3007214 Specdb::MsMs 3007215 Specdb::MsMs 3007216 HMDB41389 6854 #<Reference:0x000055ce32869c40> Allium Type 1 specific Allium 4678 Chives Type 1 specific Allium schoenoprasum 74900 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 Soft-necked garlic Type 1 specific Allium sativum L. var. sativum 4682 5.5 5.5 5.5 mg/100 g Welsh onion Type 1 specific Allium fistulosum 35875 alliaceous garlic green onion Anti-cancer 159 A substance that inhibits or prevents the proliferation of neoplasms. Antitumor 672 A substance that inhibits or prevents the proliferation of neoplasms.