1.0 2016-05-25 02:59:13 UTC 2026-04-02 22:58:28 UTC Pentaerythrityl tetraoctanoate SmallMolecule Pentaerythrityl tetraoctanoate is an organic compound with the chemical formula C37H68O8. Pentaerythrityl tetraoctanoate belongs to the tetracarboxylic acids and derivatives, a subclass of carboxylic acids and derivatives within the organic compounds. With an average molecular weight of 640.94 g/mol, Pentaerythrityl tetraoctanoate is a heavy molecule. This substance is found in or released from ten recorded sources. Within the category of electrical and electronic equipment, it is associated with antennas, electric switches, emergency protective devices, power cables, and radio transmission systems, among two other sources. In the context of household cleaning and consumer products, the compound is found in bleaching agents and cigar cigarettes. Additionally, it is recorded in building and construction materials, specifically in floors. C37H68O8 640.943 640.49141915 3-[(2-ethylhexanoyl)oxy]-2,2-bis({[(2-ethylhexanoyl)oxy]methyl})propyl 2-ethylhexanoate 3-[(2-ethylhexanoyl)oxy]-2,2-bis({[(2-ethylhexanoyl)oxy]methyl})propyl 2-ethylhexanoate 115-83-3 CCCCC(CC)C(=O)OCC(COC(=O)C(CC)CCCC)(COC(=O)C(CC)CCCC)COC(=O)C(CC)CCCC InChI=1S/C37H68O8/c1-9-17-21-29(13-5)33(38)42-25-37(26-43-34(39)30(14-6)22-18-10-2,27-44-35(40)31(15-7)23-19-11-3)28-45-36(41)32(16-8)24-20-12-4/h29-32H,9-28H2,1-8H3 DRRMRHKHTQRWMB-UHFFFAOYSA-N Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Tetracarboxylic acids and derivatives Tetracarboxylic acids and derivatives Carbonyl compounds Carboxylic acid esters Fatty acid esters Hydrocarbon derivatives Organic oxides Aliphatic acyclic compound Carbonyl group Carboxylic acid ester Fatty acid ester Fatty acyl Hydrocarbon derivative Organic oxide Organic oxygen compound Organooxygen compound Tetracarboxylic acid or derivatives Aliphatic acyclic compounds Detected and Not Quantified logp 7.23 ALOGPS logs -6.96 ALOGPS solubility 6.96e-05 g/l ALOGPS logp 11.11 ChemAxon pka_strongest_basic -6.5 ChemAxon iupac 3-[(2-ethylhexanoyl)oxy]-2,2-bis({[(2-ethylhexanoyl)oxy]methyl})propyl 2-ethylhexanoate ChemAxon average_mass 640.943 ChemAxon mono_mass 640.49141915 ChemAxon smiles CCCCC(CC)C(=O)OCC(COC(=O)C(CC)CCCC)(COC(=O)C(CC)CCCC)COC(=O)C(CC)CCCC ChemAxon formula C37H68O8 ChemAxon inchi InChI=1S/C37H68O8/c1-9-17-21-29(13-5)33(38)42-25-37(26-43-34(39)30(14-6)22-18-10-2,27-44-35(40)31(15-7)23-19-11-3)28-45-36(41)32(16-8)24-20-12-4/h29-32H,9-28H2,1-8H3 ChemAxon inchikey DRRMRHKHTQRWMB-UHFFFAOYSA-N ChemAxon polar_surface_area 105.2 ChemAxon refractivity 178.76 ChemAxon polarizability 75.39 ChemAxon rotatable_bond_count 32 ChemAxon acceptor_count 4 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f72724ff510> 61037 54996