1.0 2026-09-21 19:04:38 UTC 2026-09-21 19:04:38 UTC FDB116942 gemfibrozil 5-(2,5-dimethylphenoxy)-2,2-dimethyl-pentanoic acid 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid C15H22O3 250.3334 250.15689457 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid gemfibrozil CC1=CC(OCCCC(C)(C)C(O)=O)=C(C)C=C1 InChI=1S/C15H22O3/c1-11-6-7-12(2)13(10-11)18-9-5-8-15(3,4)14(16)17/h6-7,10H,5,8-9H2,1-4H3,(H,16,17) HEMJJKBWTPKOJG-UHFFFAOYSA-N belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring. Phenol ethers Organic compounds Benzenoids Phenol ethers Aromatic homomonocyclic compounds Alkyl aryl ethers Carbonyl compounds Carboxylic acids Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Phenoxy compounds p-Xylenes Alkyl aryl ether Aromatic homomonocyclic compound Carbonyl group Carboxylic acid Carboxylic acid derivative Ether Hydrocarbon derivative Monocarboxylic acid or derivatives Monocyclic benzene moiety Organic oxide Organic oxygen compound Organooxygen compound P-xylene Phenol ether Phenoxy compound Xylene aromatic ether logp 3.61 ALOGPS logs -3.95 ALOGPS solubility 2.78e-02 g/l ALOGPS logp 4.39 ChemAxon pka_strongest_acidic 4.42 ChemAxon pka_strongest_basic -4.8 ChemAxon iupac 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid ChemAxon average_mass 250.3334 ChemAxon mono_mass 250.15689457 ChemAxon smiles CC1=CC(OCCCC(C)(C)C(O)=O)=C(C)C=C1 ChemAxon formula C15H22O3 ChemAxon inchi InChI=1S/C15H22O3/c1-11-6-7-12(2)13(10-11)18-9-5-8-15(3,4)14(16)17/h6-7,10H,5,8-9H2,1-4H3,(H,16,17) ChemAxon inchikey HEMJJKBWTPKOJG-UHFFFAOYSA-N ChemAxon polar_surface_area 46.53 ChemAxon refractivity 71.82 ChemAxon polarizability 28.9 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::NmrOneD 2306 Specdb::NmrOneD 3010 Specdb::CMs 23955 Specdb::CMs 40657 Specdb::CMs 160098 Specdb::MsMs 60549 Specdb::MsMs 60550 Specdb::MsMs 60551 Specdb::MsMs 116892 Specdb::MsMs 116893 Specdb::MsMs 116894 Specdb::MsMs 436332 Specdb::MsMs 436333 Specdb::MsMs 436334 Specdb::MsMs 436335 Specdb::MsMs 436336 Specdb::MsMs 436337 Specdb::MsMs 440672 Specdb::MsMs 440673 Specdb::MsMs 443620 Specdb::MsMs 443621 Specdb::MsMs 443622 Specdb::MsMs 443623 Specdb::MsMs 443624 Specdb::MsMs 443625 Specdb::MsMs 2228568 Specdb::MsMs 2228666 Specdb::MsMs 2230761 Specdb::MsMs 2230903 Specdb::MsMs 2236553