1.0 2010-04-08 22:10:24 UTC 2019-11-26 03:07:46 UTC FDB012865 9-Methyldecanoic acid Trace fatty acid found in aroma of cooked mutton 9-Methylcapric acid C11H22O2 186.2912 186.161979948 9-methyldecanoic acid 9-methyldecanoic acid 1119-63-7 CC(C)CCCCCCCC(O)=O InChI=1S/C11H22O2/c1-10(2)8-6-4-3-5-7-9-11(12)13/h10H,3-9H2,1-2H3,(H,12,13) VSAJTRPXXNCHGB-UHFFFAOYSA-N belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms. Medium-chain fatty acids Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty acids and conjugates Aliphatic acyclic compounds Branched fatty acids Carbonyl compounds Carboxylic acids Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Aliphatic acyclic compound Branched fatty acid Carbonyl group Carboxylic acid Carboxylic acid derivative Hydrocarbon derivative Medium-chain fatty acid Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Branched fatty acids logp 4.21 ALOGPS logs -3.80 ALOGPS solubility 2.95e-02 g/l ALOGPS logp 3.88 ChemAxon pka_strongest_acidic 4.72 ChemAxon iupac 9-methyldecanoic acid ChemAxon average_mass 186.2912 ChemAxon mono_mass 186.161979948 ChemAxon smiles CC(C)CCCCCCCC(O)=O ChemAxon formula C11H22O2 ChemAxon inchi InChI=1S/C11H22O2/c1-10(2)8-6-4-3-5-7-9-11(12)13/h10H,3-9H2,1-2H3,(H,12,13) ChemAxon inchikey VSAJTRPXXNCHGB-UHFFFAOYSA-N ChemAxon polar_surface_area 37.3 ChemAxon refractivity 54.03 ChemAxon polarizability 23.46 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 26540 Specdb::CMs 43885 Specdb::CMs 158319 Specdb::MsMs 94770 Specdb::MsMs 94771 Specdb::MsMs 94772 Specdb::MsMs 158871 Specdb::MsMs 158872 Specdb::MsMs 158873 Specdb::MsMs 2745015 Specdb::MsMs 2745016 Specdb::MsMs 2745017 Specdb::MsMs 2937265 Specdb::MsMs 2937266 Specdb::MsMs 2937267 Specdb::MsIr 6617 Specdb::MsIr 6618 Specdb::MsIr 6619 HMDB34456 #<Reference:0x000055ce31923f88>