1.0 2010-04-08 22:13:39 UTC 2015-07-21 06:27:15 UTC FDB018351 2-Methyl-2-(methyldithio)propanal Meat-like flavouring for seasonings etc. 2-(Methyldithio)isobutyraldehyde 2-Methyl-2-(methyldithio)-propanal 2-Methyl-2-(methyldithio)propionaldehyde Alpha-(methyldithio)isobutyraldehyde FEMA 3866 Propanal, 2-methyl-2-(methyldithio)- C5H10OS2 150.262 150.017306322 2-methyl-2-(methyldisulfanyl)propanal 2-methyl-2-(methyldisulfanyl)propanal 67952-60-7 CSSC(C)(C)C=O InChI=1S/C5H10OS2/c1-5(2,4-6)8-7-3/h4H,1-3H3 VLBWEJJOETYCSE-UHFFFAOYSA-N belongs to the class of organic compounds known as dialkyldisulfides. These are organic compounds containing a disulfide group R-SS-R' where R and R' are both alkyl groups. Dialkyldisulfides Organic compounds Organosulfur compounds Organic disulfides Dialkyldisulfides Aliphatic acyclic compounds Aldehydes Hydrocarbon derivatives Organic oxides Sulfenyl compounds Aldehyde Aliphatic acyclic compound Carbonyl group Dialkyldisulfide Hydrocarbon derivative Organic oxide Organic oxygen compound Organooxygen compound Sulfenyl compound logp 1.83 ALOGPS logs -2.13 ALOGPS solubility 1.10e+00 g/l ALOGPS logp 1.59 ChemAxon pka_strongest_basic -7.3 ChemAxon iupac 2-methyl-2-(methyldisulfanyl)propanal ChemAxon average_mass 150.262 ChemAxon mono_mass 150.017306322 ChemAxon smiles CSSC(C)(C)C=O ChemAxon formula C5H10OS2 ChemAxon inchi InChI=1S/C5H10OS2/c1-5(2,4-6)8-7-3/h4H,1-3H3 ChemAxon inchikey VLBWEJJOETYCSE-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 41.43 ChemAxon polarizability 15.58 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 8035 Specdb::MsIr 8036 Specdb::CMs 16178 Specdb::CMs 148793 Specdb::MsMs 107283 Specdb::MsMs 107284 Specdb::MsMs 107285 Specdb::MsMs 174219 Specdb::MsMs 174220 Specdb::MsMs 174221 Specdb::MsMs 2737930 Specdb::MsMs 2737931 Specdb::MsMs 2737932 Specdb::MsMs 2970480 Specdb::MsMs 2970481 Specdb::MsMs 2970482 HMDB38889 #<Reference:0x000055ce3278b698> aromatic chocolate cocoa dark fat smoke