1.0 2010-04-08 22:12:16 UTC 2015-07-20 23:26:04 UTC FDB016147 2-Ethylidenehexanal Flavouring ingredient, imparting sweet nutty flavour 2-Butyl-2-butenal 2-Ethylidene-hexanal 2-Ethylidinehexanal FEMA 3392 Hexanal, 2-ethylidene- C8H14O 126.1962 126.10446507 (2E)-2-ethylidenehexanal (2E)-2-ethylidenehexanal 25409-08-9 CCCC\C(=C/C)C=O InChI=1S/C8H14O/c1-3-5-6-8(4-2)7-9/h4,7H,3,5-6H2,1-2H3/b8-4+ RAPHJZMCZKGDSB-XBXARRHUSA-N belongs to the class of organic compounds known as medium-chain aldehydes. These are an aldehyde with a chain length containing between 6 and 12 carbon atoms. Medium-chain aldehydes Organic compounds Organic oxygen compounds Organooxygen compounds Carbonyl compounds Aliphatic acyclic compounds Enals Hydrocarbon derivatives Organic oxides Aliphatic acyclic compound Alpha,beta-unsaturated aldehyde Enal Hydrocarbon derivative Medium-chain aldehyde Organic oxide logp 2.80 ALOGPS logs -2.02 ALOGPS solubility 1.22e+00 g/l ALOGPS logp 2.49 ChemAxon pka_strongest_basic -4.2 ChemAxon iupac (2E)-2-ethylidenehexanal ChemAxon average_mass 126.1962 ChemAxon mono_mass 126.10446507 ChemAxon smiles CCCC\C(=C/C)C=O ChemAxon formula C8H14O ChemAxon inchi InChI=1S/C8H14O/c1-3-5-6-8(4-2)7-9/h4,7H,3,5-6H2,1-2H3/b8-4+ ChemAxon inchikey RAPHJZMCZKGDSB-XBXARRHUSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 40.2 ChemAxon polarizability 15.32 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 18379 Specdb::CMs 132448 Specdb::CMs 140182 Specdb::MsIr 7417 Specdb::MsIr 7418 Specdb::MsMs 57429 Specdb::MsMs 57430 Specdb::MsMs 57431 Specdb::MsMs 113088 Specdb::MsMs 113089 Specdb::MsMs 113090 Specdb::MsMs 2731468 Specdb::MsMs 2731469 Specdb::MsMs 2731470 Specdb::MsMs 2977130 Specdb::MsMs 2977131 Specdb::MsMs 2977132 HMDB37152 #<Reference:0x000055ce320b4c98> cooked roasted