1.0 2010-04-08 22:09:18 UTC 2015-07-20 22:35:34 UTC FDB010803 Peroxyoctanoic acid Component of antimicrobial washes for poultry carcasses Kayaester o Kayaester O 50 Octaneperoxoic acid, 1,1-dimethylethyl ester Octaneperoxoic acid, 9CI Peroctanoic acid Peroxyoctanoic acid, tert-butyl ester Tert-butyl octaneperoxoate Tert-butyl percaprylate Tert-butyl peroctanoate Tert-butyl peroctoate Tert-butyl peroxyoctanoate Tert-butyl peroxyoctoate C8H16O3 160.2108 160.109944378 octaneperoxoic acid octaneperoxoic acid 33734-57-5 CCCCCCCC(=O)OO InChI=1S/C8H16O3/c1-2-3-4-5-6-7-8(9)11-10/h10H,2-7H2,1H3 CVXHBROPWMVEQO-UHFFFAOYSA-N belongs to the class of organic compounds known as peroxycarboxylic acids. These are organic acids with the general formula [H]OOC(R)=O (R = H, organyl group). Peroxycarboxylic acids Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Peroxycarboxylic acids and derivatives Aliphatic acyclic compounds Carbonyl compounds Carboxylic acid salts Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic hydroperoxides Organic oxides Organic salts Peroxols Aliphatic acyclic compound Carbonyl group Carboxylic acid salt Hydrocarbon derivative Hydroperoxide Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organic salt Organooxygen compound Peroxol Peroxycarboxylic acid logp 2.46 ALOGPS logs -2.04 ALOGPS solubility 1.45e+00 g/l ALOGPS melting_point Mp 31-32° logp 2.62 ChemAxon pka_strongest_acidic 7.66 ChemAxon pka_strongest_basic -6 ChemAxon iupac octaneperoxoic acid ChemAxon average_mass 160.2108 ChemAxon mono_mass 160.109944378 ChemAxon smiles CCCCCCCC(=O)OO ChemAxon formula C8H16O3 ChemAxon inchi InChI=1S/C8H16O3/c1-2-3-4-5-6-7-8(9)11-10/h10H,2-7H2,1H3 ChemAxon inchikey CVXHBROPWMVEQO-UHFFFAOYSA-N ChemAxon polar_surface_area 46.53 ChemAxon refractivity 41.91 ChemAxon polarizability 18.18 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 23165 Specdb::CMs 168760 Specdb::MsIr 5740 Specdb::MsIr 5741 Specdb::MsIr 5742 Specdb::MsMs 106044 Specdb::MsMs 106045 Specdb::MsMs 106046 Specdb::MsMs 172689 Specdb::MsMs 172690 Specdb::MsMs 172691 Specdb::MsMs 2299581 Specdb::MsMs 2299582 Specdb::MsMs 2299583 Specdb::MsMs 2638546 Specdb::MsMs 2638547 Specdb::MsMs 2638548 HMDB32827 #<Reference:0x000055ce30d2b870>