1.0 2010-04-08 22:10:14 UTC 2025-11-18 23:37:56 UTC FDB012564 Betamipron Artificial sweetener 3-(Benzoylamino)propionic acid 3-Benzamidopropanoic acid 3-Benzamidopropionic acid Benzoyl-beta-alanine Beta-alanine, n-benzoyl- Betamipron Betamipron (jan/inn) Betamipron [inn:jan] Betamipron, INN N-(phenylcarbonyl)-beta-alanine N-Benzoyl-b-alanine, 9CI N-benzoyl-beta-alanine N-benzoylalanine C10H11NO3 193.1992 193.073893223 3-(phenylformamido)propanoic acid β-alanine, N-benzoyl- 3440-28-6 OC(=O)CCNC(=O)C1=CC=CC=C1 InChI=1S/C10H11NO3/c12-9(13)6-7-11-10(14)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,14)(H,12,13) CWXYHOHYCJXYFQ-UHFFFAOYSA-N belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene. Benzene and substituted derivatives Organic compounds Benzenoids Benzene and substituted derivatives Aromatic homomonocyclic compounds Carbonyl compounds Carboximidic acids Carboxylic acids Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds Propargyl-type 1,3-dipolar organic compounds Aromatic homomonocyclic compound Carbonyl group Carboximidic acid Carboximidic acid derivative Carboxylic acid Carboxylic acid derivative Hydrocarbon derivative Monocarboxylic acid or derivatives Monocyclic benzene moiety Organic 1,3-dipolar compound Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Propargyl-type 1,3-dipolar organic compound logp 0.43 ALOGPS logs -2.34 ALOGPS solubility 8.92e-01 g/l ALOGPS melting_point Mp 120° logp 0.76 ChemAxon pka_strongest_acidic 4.11 ChemAxon pka_strongest_basic -0.85 ChemAxon iupac 3-(phenylformamido)propanoic acid ChemAxon average_mass 193.1992 ChemAxon mono_mass 193.073893223 ChemAxon smiles OC(=O)CCNC(=O)C1=CC=CC=C1 ChemAxon formula C10H11NO3 ChemAxon inchi InChI=1S/C10H11NO3/c12-9(13)6-7-11-10(14)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,14)(H,12,13) ChemAxon inchikey CWXYHOHYCJXYFQ-UHFFFAOYSA-N ChemAxon polar_surface_area 66.4 ChemAxon refractivity 50.82 ChemAxon polarizability 19.73 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 3 ChemAxon donor_count 2 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 6521 Specdb::MsIr 6522 Specdb::MsIr 6523 Specdb::CMs 12225 Specdb::CMs 43778 Specdb::CMs 172969 Specdb::MsMs 49431 Specdb::MsMs 49432 Specdb::MsMs 49433 Specdb::MsMs 133893 Specdb::MsMs 133894 Specdb::MsMs 133895 Specdb::MsMs 375013 Specdb::MsMs 451819 Specdb::MsMs 2403056 Specdb::MsMs 2403057 Specdb::MsMs 2403058 Specdb::MsMs 2535200 Specdb::MsMs 2535201 Specdb::MsMs 2535202 HMDB34250 BYA #<Reference:0x000055ce33127e40>