1.0 2010-04-08 22:04:54 UTC 2020-02-24 19:10:22 UTC FDB001289 Bissulfine Constituent of onion (Allium cepa). Bissulfine is found in garden onion and onion-family vegetables. Bissulfine C6H10O2S2 178.272 178.012220944 2,3-dimethyl-1,4-disulfinylidenebutane 2,3-dimethyl-1,4-disulfinylidenebutane 127793-93-5 CC(C=S=O)C(C)C=S=O InChI=1S/C6H10O2S2/c1-5(3-9-7)6(2)4-10-8/h3-6H,1-2H3 RUYPPTVRJRANOX-UHFFFAOYSA-N belongs to the class of organic compounds known as thioaldehyde s-oxides. Thioaldehyde s-oxides are compounds having the general structure RC(=S=O)H. Thioaldehyde s-oxides Organic compounds Organosulfur compounds Thiocarbonyl compounds Thioaldehydes Aliphatic acyclic compounds Hydrocarbon derivatives Organic oxides Sulfines Sulfinyl compounds Aliphatic acyclic compound Hydrocarbon derivative Organic oxide Organic oxygen compound Sulfine Sulfinyl compound Thioaldehyde-s-oxide logp -0.20 ALOGPS logs -1.27 ALOGPS solubility 9.57e+00 g/l ALOGPS melting_point Mp 48° dec. logp 2.12 ChemAxon iupac 2,3-dimethyl-1,4-disulfinylidenebutane ChemAxon average_mass 178.272 ChemAxon mono_mass 178.012220944 ChemAxon smiles CC(C=S=O)C(C)C=S=O ChemAxon formula C6H10O2S2 ChemAxon inchi InChI=1S/C6H10O2S2/c1-5(3-9-7)6(2)4-10-8/h3-6H,1-2H3 ChemAxon inchikey RUYPPTVRJRANOX-UHFFFAOYSA-N ChemAxon polar_surface_area 34.14 ChemAxon refractivity 42.47 ChemAxon polarizability 17.32 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 14683 Specdb::CMs 162868 Specdb::MsMs 101208 Specdb::MsMs 101209 Specdb::MsMs 101210 Specdb::MsMs 166764 Specdb::MsMs 166765 Specdb::MsMs 166766 Specdb::MsMs 2666680 Specdb::MsMs 2666681 Specdb::MsMs 2666682 Specdb::MsMs 3011316 Specdb::MsMs 3011317 Specdb::MsMs 3011318 Specdb::NmrOneD 160450 Specdb::NmrOneD 160451 Specdb::NmrOneD 160452 Specdb::NmrOneD 160453 Specdb::NmrOneD 160454 Specdb::NmrOneD 160455 Specdb::NmrOneD 160456 Specdb::NmrOneD 160457 Specdb::NmrOneD 160458 Specdb::NmrOneD 160459 Specdb::NmrOneD 160460 Specdb::NmrOneD 160461 Specdb::NmrOneD 160462 Specdb::NmrOneD 160463 Specdb::NmrOneD 160464 Specdb::NmrOneD 160465 Specdb::NmrOneD 160466 Specdb::NmrOneD 160467 Specdb::NmrOneD 160468 Specdb::NmrOneD 160469 HMDB30000 #<Reference:0x000055ce304ffea8> 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