1.0 2016-05-19 04:40:51 UTC 2026-08-22 20:55:09 UTC 1,1,1-Tris(hydroxymethyl)ethane SmallMolecule 1,1,1-Tris(hydroxymethyl)ethane belongs to the alcohols and polyols, a subclass of organooxygen compounds within the organic compounds. This organic oxygen compound has the chemical formula C5H12O3 and an average molecular weight of 120.15 g/mol. In industrial applications, it is utilized as a plasticizer and is present in Polyethylene Terephthalate. The compound is associated with 26 recorded sources. Within the category of electrical and electronic equipment, it is found in antennas, coils, conductors or conductive bodies characterised by the conductive materials, electric switches, and electrically stimulated smoking devices, among seven other sources. In the realm of household cleaning and consumer products, it appears in bleaching agents, cigar cigarettes, perfumes within detergents and soaps, pipe accessories, other smoking requisites, and two additional sources. Building and construction sources include floors, ladders, roofs, and fencing. Furthermore, it is linked to food, food processing and cookware, specifically in food preservation, food contact materials, and fermentation processes for beer. Recorded exposure routes for 1,1,1-Tris(hydroxymethyl)ethane include touch, oral, and inhalation. 1,3-Propanediol, 2-(hydroxymethyl)-2-methyl- 2-(Hydroxymethyl)-2-methyl-1,3-propanediol C5H12O3 120.148 120.078644246 2-(hydroxymethyl)-2-methylpropane-1,3-diol trimet 77-85-0 CC(CO)(CO)CO InChI=1S/C5H12O3/c1-5(2-6,3-7)4-8/h6-8H,2-4H2,1H3 QXJQHYBHAIHNGG-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 Detected and Not Quantified logp -1.2 logp -1.34 ALOGPS logs 0.70 ALOGPS solubility 5.99e+02 g/l ALOGPS logp -1.5 ChemAxon pka_strongest_acidic 14.5 ChemAxon pka_strongest_basic -2.8 ChemAxon iupac 2-(hydroxymethyl)-2-methylpropane-1,3-diol ChemAxon average_mass 120.148 ChemAxon mono_mass 120.078644246 ChemAxon smiles CC(CO)(CO)CO ChemAxon formula C5H12O3 ChemAxon inchi InChI=1S/C5H12O3/c1-5(2-6,3-7)4-8/h6-8H,2-4H2,1H3 ChemAxon inchikey QXJQHYBHAIHNGG-UHFFFAOYSA-N ChemAxon polar_surface_area 60.69 ChemAxon refractivity 29.95 ChemAxon polarizability 12.63 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 3 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7226b7e248> 6502 6256