1.0 2010-04-08 22:15:33 UTC 2015-07-21 06:51:28 UTC FDB021233 4-tert-Butylphenyl salicylate Migration residue from food packaging 4-tert-Butylphenyl salicylate Benzoic acid, 2-hydroxy-, 4-(1,1-dimethylethyl)phenyl ester P-terc.butylfenylester kyseliny salicylove P-tert-butylphenyl salicylate P-tert-butylphenylsalicylate Salicyclic acid p-tert-butylphenyl ester Salicylic acid p-tert-butylphenyl ester Salicylic acid, p-tert-butylphenyl ester Seesorb 202 Sumisorb 90 UV Absorber NL 3 UV Absorber NL/3 Viosorb 90 C17H18O3 270.323 270.125594442 4-tert-butylphenyl 2-hydroxybenzoate 4-tert-butylphenyl 2-hydroxybenzoate 87-18-3 CC(C)(C)C1=CC=C(OC(=O)C2=CC=CC=C2O)C=C1 InChI=1S/C17H18O3/c1-17(2,3)12-8-10-13(11-9-12)20-16(19)14-6-4-5-7-15(14)18/h4-11,18H,1-3H3 DBOSBRHMHBENLP-UHFFFAOYSA-N belongs to the class of organic compounds known as depsides and depsidones. These are polycyclic compounds that is either a polyphenolic compound composed of two or more monocyclic aromatic units linked by an ester bond (depside), or a compound containing the depsidone structure (depsidone). Depsides and depsidones Organic compounds Phenylpropanoids and polyketides Depsides and depsidones 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 Organooxygen compounds Phenol esters Phenoxy compounds Phenylpropanes Salicylic acid and derivatives Vinylogous acids o-Hydroxybenzoic acid esters 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid Aromatic homomonocyclic compound Benzenoid Benzoate ester Benzoic acid or derivatives Benzoyl Carboxylic acid derivative Carboxylic acid ester Depside backbone Hydrocarbon derivative Monocarboxylic acid or derivatives Monocyclic benzene moiety O-hydroxybenzoic acid ester Organic oxide Organic oxygen compound Organooxygen compound Phenol Phenol ester Phenoxy compound Phenylpropane Salicylic acid or derivatives Vinylogous acid logp 4.97 ALOGPS logs -4.18 ALOGPS solubility 1.80e-02 g/l ALOGPS melting_point Mp 65-66° logp 5.53 ChemAxon pka_strongest_acidic 9.67 ChemAxon pka_strongest_basic -4.3 ChemAxon iupac 4-tert-butylphenyl 2-hydroxybenzoate ChemAxon average_mass 270.323 ChemAxon mono_mass 270.125594442 ChemAxon smiles CC(C)(C)C1=CC=C(OC(=O)C2=CC=CC=C2O)C=C1 ChemAxon formula C17H18O3 ChemAxon inchi InChI=1S/C17H18O3/c1-17(2,3)12-8-10-13(11-9-12)20-16(19)14-6-4-5-7-15(14)18/h4-11,18H,1-3H3 ChemAxon inchikey DBOSBRHMHBENLP-UHFFFAOYSA-N ChemAxon polar_surface_area 46.53 ChemAxon refractivity 78.51 ChemAxon polarizability 30.04 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::EiMs 346 Specdb::NmrOneD 2681 Specdb::NmrOneD 3367 Specdb::CMs 23334 Specdb::CMs 47253 Specdb::CMs 133761 Specdb::CMs 141495 Specdb::MsMs 77337 Specdb::MsMs 77338 Specdb::MsMs 77339 Specdb::MsMs 137436 Specdb::MsMs 137437 Specdb::MsMs 137438 Specdb::MsMs 2690795 Specdb::MsMs 2690796 Specdb::MsMs 2690797 Specdb::MsMs 2988710 Specdb::MsMs 2988711 Specdb::MsMs 2988712 HMDB41314 #<Reference:0x000055ce30fbf960>