1.0 2010-04-08 22:12:40 UTC 2015-07-20 23:32:57 UTC FDB016821 Allyl anthranilate Flavour ingredient 2-Propen-1-yl 2-aminobenzoate 2-Propen-1-yl anthranilate 2-Propenyl 2-aminobenzoate Allyl 2-aminobenzoate Allyl anthranilate Allyl o-aminobenzoate Anthranilic acid, allyl ester Anthranilic acid, allyl ester (8ci) Benzoic acid, 2-amino-, 2-propenyl ester FEMA 2020 Vinyl carbinyl anthranilate C10H11NO2 177.1998 177.078978601 prop-2-en-1-yl 2-aminobenzoate prop-2-en-1-yl 2-aminobenzoate 7493-63-2 NC1=CC=CC=C1C(=O)OCC=C InChI=1S/C10H11NO2/c1-2-7-13-10(12)8-5-3-4-6-9(8)11/h2-6H,1,7,11H2 UCANFCXAKYMFGA-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 logp 1.76 ALOGPS logs -1.64 ALOGPS solubility 4.05e+00 g/l ALOGPS logp 2.53 ChemAxon pka_strongest_acidic 19.39 ChemAxon pka_strongest_basic 2.16 ChemAxon iupac prop-2-en-1-yl 2-aminobenzoate ChemAxon average_mass 177.1998 ChemAxon mono_mass 177.078978601 ChemAxon smiles NC1=CC=CC=C1C(=O)OCC=C ChemAxon formula C10H11NO2 ChemAxon inchi InChI=1S/C10H11NO2/c1-2-7-13-10(12)8-5-3-4-6-9(8)11/h2-6H,1,7,11H2 ChemAxon inchikey UCANFCXAKYMFGA-UHFFFAOYSA-N ChemAxon polar_surface_area 52.32 ChemAxon refractivity 51.95 ChemAxon polarizability 18.7 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 7596 Specdb::MsIr 7597 Specdb::MsIr 7598 Specdb::CMs 23563 Specdb::CMs 27949 Specdb::CMs 29145 Specdb::CMs 101880 Specdb::CMs 101881 Specdb::CMs 136254 Specdb::CMs 143988 Specdb::NmrOneD 22582 Specdb::NmrOneD 22583 Specdb::NmrOneD 22584 Specdb::NmrOneD 22585 Specdb::NmrOneD 22586 Specdb::NmrOneD 22587 Specdb::NmrOneD 22588 Specdb::NmrOneD 22589 Specdb::NmrOneD 22590 Specdb::NmrOneD 22591 Specdb::NmrOneD 22592 Specdb::NmrOneD 22593 Specdb::NmrOneD 22594 Specdb::NmrOneD 22595 Specdb::NmrOneD 22596 Specdb::NmrOneD 22597 Specdb::NmrOneD 22598 Specdb::NmrOneD 22599 Specdb::NmrOneD 22600 Specdb::NmrOneD 22601 Specdb::MsMs 68007 Specdb::MsMs 68008 Specdb::MsMs 68009 Specdb::MsMs 125952 Specdb::MsMs 125953 Specdb::MsMs 125954 Specdb::MsMs 2364817 Specdb::MsMs 2364818 Specdb::MsMs 2364819 Specdb::MsMs 2597488 Specdb::MsMs 2597489 Specdb::MsMs 2597490 HMDB37693 #<Reference:0x000055ac40f11b10> floral grape green leaf