1.0 2016-05-19 03:10:28 UTC 2026-05-14 17:46:15 UTC 1,3-Propanediol, 2,2-dimethyl- SmallMolecule 1,3-Propanediol, 2,2-dimethyl- belongs to the alcohols and polyols, a subclass of organooxygen compounds within the organic compounds. This compound has the formula C3H8O2 and an average molecular weight of 76.09 g/mol. It is utilized industrially as a solvent and a plasticizer. The substance is found in or released from 33 recorded sources. These include electrical and electronic equipment such as antennas, auxiliary devices, communication cables or conductors, conductors or conductive bodies characterised by the conductive materials, and electric hearing aids, among eight others. Within household cleaning and consumer products, it is associated with bleaching agents, cigar cigarettes, non electric simulated smoking devices, other smoking requisites, and perfumes within detergents and soaps, among five others. It is also linked to food, food processing and cookware, specifically food contact materials, fermentation processes for beer, food preservation, the preparation of vinegar, and the preparation of wine or sparkling wine, among two others. Additionally, it is found in building and construction materials such as floors, stairs and ramps, as well as household items like watch chains. Recorded exposure routes for 1,3-Propanediol, 2,2-dimethyl- include inhalation, oral, and touch. Two recorded protein targets for this compound are haloalkane dehalogenase (linB) and ADP-ribosylation factor 1 (ARF1). 1,3-Propanediol 2,2-dimethylpropane-1,3-diol 2,2-Dimethylpropane-1,3-diol propane-1,3-diol C3H8O2 76.0944 76.0524295 propane-1,3-diol propanediol 126-30-7 OCCCO InChI=1S/C3H8O2/c4-2-1-3-5/h4-5H,1-3H2 YPFDHNVEDLHUCE-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 a small molecule propane-1,3-diols Detected and Not Quantified logp -1.1 logp -1.18 ALOGPS logs 1.05 ALOGPS solubility 8.59e+02 g/l ALOGPS logp -1.1 ChemAxon pka_strongest_acidic 15.6 ChemAxon pka_strongest_basic -2.4 ChemAxon iupac propane-1,3-diol ChemAxon average_mass 76.0944 ChemAxon mono_mass 76.0524295 ChemAxon smiles OCCCO ChemAxon formula C3H8O2 ChemAxon inchi InChI=1S/C3H8O2/c4-2-1-3-5/h4-5H,1-3H2 ChemAxon inchikey YPFDHNVEDLHUCE-UHFFFAOYSA-N ChemAxon polar_surface_area 40.46 ChemAxon refractivity 19.42 ChemAxon polarizability 8.15 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 2 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bb3c7b730> DB02774 10442 13839553 BE0003814 BE0027482