1.0 2010-04-08 22:06:21 UTC 2025-11-18 22:57:08 UTC FDB004684 p-Aminobenzaldehyde P-aminobenzaldehyde belongs to benzoyl derivatives class of compounds. Those are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-). P-aminobenzaldehyde is slightly soluble (in water) and a strong basic compound (based on its pKa). P-aminobenzaldehyde can be found in a number of food items such as pepper (c. annuum), yellow bell pepper, orange bell pepper, and green bell pepper, which makes P-aminobenzaldehyde a potential biomarker for the consumption of these food products. C7H7NO 121.1366 121.052763851 4-aminobenzaldehyde 4-aminobenzaldehyde NC1=CC=C(C=O)C=C1 InChI=1S/C7H7NO/c8-7-3-1-6(5-9)2-4-7/h1-5H,8H2 VATYWCRQDJIRAI-UHFFFAOYSA-N belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-). Benzoyl derivatives Organic compounds Benzenoids Benzene and substituted derivatives Benzoyl derivatives Aromatic homomonocyclic compounds Aniline and substituted anilines Benzaldehydes Hydrocarbon derivatives Organic oxides Organopnictogen compounds Primary amines Aldehyde Amine Aniline or substituted anilines Aromatic homomonocyclic compound Aryl-aldehyde Benzaldehyde Benzoyl Hydrocarbon derivative Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary amine logp 0.91 ALOGPS logs -1.21 ALOGPS solubility 7.53e+00 g/l ALOGPS logp 0.86 ChemAxon pka_strongest_basic 3.02 ChemAxon iupac 4-aminobenzaldehyde ChemAxon average_mass 121.1366 ChemAxon mono_mass 121.052763851 ChemAxon smiles NC1=CC=C(C=O)C=C1 ChemAxon formula C7H7NO ChemAxon inchi InChI=1S/C7H7NO/c8-7-3-1-6(5-9)2-4-7/h1-5H,8H2 ChemAxon inchikey VATYWCRQDJIRAI-UHFFFAOYSA-N ChemAxon polar_surface_area 43.09 ChemAxon refractivity 37.34 ChemAxon polarizability 12.46 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 67182 Specdb::MsMs 67183 Specdb::MsMs 67184 Specdb::MsMs 124932 Specdb::MsMs 124933 Specdb::MsMs 124934 Specdb::MsMs 3600830 Specdb::MsMs 3600831 Specdb::MsMs 3600832 Specdb::MsMs 3600833 Specdb::MsMs 3600834 Specdb::MsMs 3600835 Green bell pepper Type 1 specific Capsicum annuum 4072 0.6 0.6 0.6 mg/100 g Orange bell pepper Type 1 specific Capsicum annuum 4072 0.6 0.6 0.6 mg/100 g Pepper Type 1 specific Capsicum annuum 4072 0.6 0.6 0.6 mg/100 g Red bell pepper Type 1 specific Capsicum annuum 4072 0.6 0.6 0.6 mg/100 g Yellow bell pepper Type 1 specific Capsicum annuum 4072 0.6 0.6 0.6 mg/100 g