1.0 2010-04-08 22:12:06 UTC 2018-05-29 01:22:55 UTC FDB015869 Butyl anthranilate It is used in fruit food flavouring 2-Aminobenzoic acid butyl ester 2-Aminobenzoic acid, butyl ester Anthranilic acid, butyl ester Anthranilic acid, butyl ester (6ci,7ci,8ci) Benzoic acid, 2-amino-, butyl ester Butyl 2-aminobenzoate Butyl anthranilate Butyl o-aminobenzoate FEMA 2181 N-Butyl anthranilate N-Butyl o-aminobenzoate C11H15NO2 193.2423 193.110278729 butyl 2-aminobenzoate butyl 2-aminobenzoate 7756-96-9 CCCCOC(=O)C1=CC=CC=C1N InChI=1S/C11H15NO2/c1-2-3-8-14-11(13)9-6-4-5-7-10(9)12/h4-7H,2-3,8,12H2,1H3 HUIYGGQINIVDNW-UHFFFAOYSA-N belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid. Benzoic acid esters Organic compounds Benzenoids Benzene and substituted derivatives Benzoic acids and derivatives Aromatic homomonocyclic compounds Amino acids and derivatives Aminobenzoic acids and derivatives Aniline and substituted anilines Benzoyl derivatives Carboxylic acid esters Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Organooxygen compounds Organopnictogen compounds Primary amines Vinylogous amides Amine Amino acid or derivatives Aminobenzoic acid or derivatives Aniline or substituted anilines Aromatic homomonocyclic compound Benzoate ester Benzoyl Carboxylic acid derivative Carboxylic acid ester Hydrocarbon derivative Monocarboxylic acid or derivatives Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary amine Vinylogous amide benzoate ester substituted aniline logp 2.87 ALOGPS logs -2.60 ALOGPS solubility 4.89e-01 g/l ALOGPS logp 3.12 ChemAxon pka_strongest_acidic 19.4 ChemAxon pka_strongest_basic 2.22 ChemAxon iupac butyl 2-aminobenzoate ChemAxon average_mass 193.2423 ChemAxon mono_mass 193.110278729 ChemAxon smiles CCCCOC(=O)C1=CC=CC=C1N ChemAxon formula C11H15NO2 ChemAxon inchi InChI=1S/C11H15NO2/c1-2-3-8-14-11(13)9-6-4-5-7-10(9)12/h4-7H,2-3,8,12H2,1H3 ChemAxon inchikey HUIYGGQINIVDNW-UHFFFAOYSA-N ChemAxon polar_surface_area 52.32 ChemAxon refractivity 56.66 ChemAxon polarizability 21.76 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 7327 Specdb::MsIr 7328 Specdb::MsIr 7329 Specdb::CMs 13085 Specdb::CMs 26785 Specdb::CMs 29146 Specdb::CMs 101843 Specdb::CMs 101844 Specdb::CMs 137342 Specdb::CMs 145076 Specdb::MsMs 68835 Specdb::MsMs 68836 Specdb::MsMs 68837 Specdb::MsMs 126957 Specdb::MsMs 126958 Specdb::MsMs 126959 Specdb::MsMs 2429731 Specdb::MsMs 2429732 Specdb::MsMs 2429733 Specdb::MsMs 2505983 Specdb::MsMs 2505984 Specdb::MsMs 2505985 HMDB36906 #<Reference:0x000055ce31bff630> berry floral fruity grape petitgrain plum powdery sweet wine