1.0 2010-04-08 22:06:11 UTC 2025-11-18 22:55:55 UTC FDB004330 1-Isohexacosanol 1-isohexacosanol is a member of the class of compounds known as fatty alcohols. Fatty alcohols are aliphatic alcohols consisting of a chain of a least six carbon atoms. 1-isohexacosanol is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). 1-isohexacosanol can be found in brussel sprouts, which makes 1-isohexacosanol a potential biomarker for the consumption of this food product. C26H54O 382.717 382.417466359 24-methylpentacosan-1-ol 24-methylpentacosan-1-ol 68444-33-7 CC(C)CCCCCCCCCCCCCCCCCCCCCCCO InChI=1S/C26H54O/c1-26(2)24-22-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-23-25-27/h26-27H,3-25H2,1-2H3 XCAKLCDEUPZJOI-UHFFFAOYSA-N belongs to the class of organic compounds known as fatty alcohols. These are aliphatic alcohols consisting of a chain of a least six carbon atoms. Fatty alcohols Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty alcohols Aliphatic acyclic compounds Hydrocarbon derivatives Primary alcohols Alcohol Aliphatic acyclic compound Fatty alcohol Hydrocarbon derivative Organic oxygen compound Organooxygen compound Primary alcohol long-chain primary fatty alcohol logp 9.96 ALOGPS logs -7.50 ALOGPS solubility 1.20e-05 g/l ALOGPS logp 10.43 ChemAxon pka_strongest_acidic 16.84 ChemAxon pka_strongest_basic -2 ChemAxon iupac 24-methylpentacosan-1-ol ChemAxon average_mass 382.717 ChemAxon mono_mass 382.417466359 ChemAxon smiles CC(C)CCCCCCCCCCCCCCCCCCCCCCCO ChemAxon formula C26H54O ChemAxon inchi InChI=1S/C26H54O/c1-26(2)24-22-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-23-25-27/h26-27H,3-25H2,1-2H3 ChemAxon inchikey XCAKLCDEUPZJOI-UHFFFAOYSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 123.3 ChemAxon polarizability 55.58 ChemAxon rotatable_bond_count 23 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 54699 Specdb::MsMs 54700 Specdb::MsMs 54701 Specdb::MsMs 125661 Specdb::MsMs 125662 Specdb::MsMs 125663 Specdb::MsMs 3600296 Specdb::MsMs 3600297 Specdb::MsMs 3600298 Specdb::MsMs 3600299 Specdb::MsMs 3600300 Specdb::MsMs 3600301 Brussel sprouts Type 1 specific Brassica oleracea var. gemmifera 178616