1.0 2016-05-19 02:10:27 UTC 2026-05-14 17:33:48 UTC ISOAMYL ALCOHOL SmallMolecule ISOAMYL ALCOHOL (C5H12O) is an organic compound with an average molecular weight of 88.15 g/mol. ISOAMYL ALCOHOL belongs to the alcohols and polyols, a subclass of organooxygen compounds within the organic compounds. In industrial applications, the compound serves as a solvent, fragrance, and as a nutrient and flavouring (PMC12317478). It is also utilized in the production of plastics, specifically in polyamide, polyethylene terephthalate, and low-density polyethylene. The compound is recorded in 29 sources, including drinking water and water supply. It is found in building and construction materials such as ladders, and household items including key rings. It is associated with household cleaning and consumer products, specifically bleaching agents, ash trays, cigar cigarettes, other smoking requisites, and non electric simulated devices for simulated smoking. Within the food, food processing and cookware category, it is linked to food contact materials and fermentation processes for beer, as well as the preparation of malt, vinegar, wine, or sparkling wine. Additionally, it is found in electrical and electronic equipment, including amplifiers, antennas, contacts, cores yokes or armatures, and discharge lamps, among nine other sources. Recorded exposure routes for the compound include touch, oral, and inhalation. Regarding biological activity, ISOAMYL ALCOHOL is a recorded inhibitor of the protein target renin (REN). 3-methylbutan-1-ol 3-methylbutanol Isopentanol Isopentyl alcohol C5H12O 88.1482 88.088815006 3-methylbutan-1-ol isoamyl alcohol 123-51-3 CC(C)CCO InChI=1S/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3 PHTQWCKDNZKARW-UHFFFAOYSA-N Organic compounds Organic oxygen compounds Organooxygen compounds Alcohols and polyols Primary alcohols Hydrocarbon derivatives Aliphatic acyclic compound Hydrocarbon derivative Primary alcohol Aliphatic acyclic compounds Fatty alcohols a small molecule alkyl alcohol primary alcohol Detected and Not Quantified logp 1.09 logp 1.33 ALOGPS logs -0.37 ALOGPS solubility 3.80e+01 g/l ALOGPS logp 1.09 ChemAxon pka_strongest_acidic 17.17 ChemAxon pka_strongest_basic -1.9 ChemAxon iupac 3-methylbutan-1-ol ChemAxon average_mass 88.1482 ChemAxon mono_mass 88.088815006 ChemAxon smiles CC(C)CCO ChemAxon formula C5H12O ChemAxon inchi InChI=1S/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3 ChemAxon inchikey PHTQWCKDNZKARW-UHFFFAOYSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 26.68 ChemAxon polarizability 11.03 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7225aa0b60> DB02296 31260 29000 BE0000270