1.0 2010-04-08 22:09:37 UTC 2018-05-28 23:30:17 UTC FDB011405 Octyl gallate Antioxidant used in margarine. Benzoic acid, 3,4,5-trihydroxy-, octyl ester E311 GA 8 GA 8 (VAN) Gallate octyl ester Gallic acid octyl ester Gallic acid, octyl ester n-Octyl ester of 3,4,5-trihydroxybenzoic acid N-octyl gallate N-Octyl gallic acid N-octylgallate Octyl 3,4,5-trihydroxybenzoate Octyl gallate Octylgallate Oktylester kyseliny gallove Progallin o Stabilizer GA 8 C15H22O5 282.3322 282.146723814 octyl 3,4,5-trihydroxybenzoate octyl gallate 1034-01-1 CCCCCCCCOC(=O)C1=CC(O)=C(O)C(O)=C1 InChI=1S/C15H22O5/c1-2-3-4-5-6-7-8-20-15(19)11-9-12(16)14(18)13(17)10-11/h9-10,16-18H,2-8H2,1H3 NRPKURNSADTHLJ-UHFFFAOYSA-N belongs to the class of organic compounds known as galloyl esters. These are organic compounds that contain an ester derivative of 3,4,5-trihydroxybenzoic acid. Galloyl esters Organic compounds Benzenoids Benzene and substituted derivatives Benzoic acids and derivatives Aromatic homomonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Benzoyl derivatives Carboxylic acid esters Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Polyols Pyrogallols and derivatives m-Hydroxybenzoic acid esters p-Hydroxybenzoic acid alkyl esters 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid Aromatic homomonocyclic compound Benzenetriol Benzoate ester Benzoyl Carboxylic acid derivative Carboxylic acid ester Galloyl ester Hydrocarbon derivative M-hydroxybenzoic acid ester Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound P-hydroxybenzoic acid alkyl ester P-hydroxybenzoic acid ester Phenol Polyol Pyrogallol derivative gallate ester logp 4.10 ALOGPS logs -3.03 ALOGPS solubility 2.61e-01 g/l ALOGPS melting_point Mp 94-95° logp 4.17 ChemAxon pka_strongest_acidic 8.11 ChemAxon pka_strongest_basic -5.5 ChemAxon iupac octyl 3,4,5-trihydroxybenzoate ChemAxon average_mass 282.3322 ChemAxon mono_mass 282.146723814 ChemAxon smiles CCCCCCCCOC(=O)C1=CC(O)=C(O)C(O)=C1 ChemAxon formula C15H22O5 ChemAxon inchi InChI=1S/C15H22O5/c1-2-3-4-5-6-7-8-20-15(19)11-9-12(16)14(18)13(17)10-11/h9-10,16-18H,2-8H2,1H3 ChemAxon inchikey NRPKURNSADTHLJ-UHFFFAOYSA-N ChemAxon polar_surface_area 86.99 ChemAxon refractivity 76.3 ChemAxon polarizability 31.8 ChemAxon rotatable_bond_count 9 ChemAxon acceptor_count 4 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::NmrOneD 2081 Specdb::NmrOneD 2775 Specdb::CMs 24976 Specdb::CMs 43270 Specdb::CMs 134368 Specdb::CMs 142102 Specdb::MsMs 78042 Specdb::MsMs 78043 Specdb::MsMs 78044 Specdb::MsMs 138294 Specdb::MsMs 138295 Specdb::MsMs 138296 Specdb::MsMs 2226287 Specdb::MsMs 2243100 Specdb::MsMs 2244914 Specdb::MsMs 2245217 Specdb::MsMs 2246958 Specdb::MsMs 2247316 Specdb::MsMs 2248953 Specdb::MsMs 2249449 Specdb::MsMs 2250997 Specdb::MsMs 2251401 Specdb::MsMs 2797634 Specdb::MsMs 2797635 Specdb::MsMs 2797636 Specdb::MsMs 2880512 Specdb::MsMs 2880513 Specdb::MsMs 2880514 HMDB33375 #<Reference:0x000055ce32db4da8> #<Reference:0x000055ce32db4ab0>