1.0 2016-05-22 03:37:55 UTC 2026-08-20 01:23:47 UTC Betaxolol SmallMolecule Betaxolol is an organic compound with the chemical formula C18H29NO3 and an average molecular weight of 307.43 g/mol. Betaxolol belongs to the tyrosols and derivatives, a subclass of phenols within the organic compounds. This compound acts as an antagonist of the Beta-1 adrenergic receptor (ADRB1) and the Beta-2 adrenergic receptor (ADRB2). The substance is found in or released from 12 recorded sources. Within healthcare, pharmaceuticals, and veterinary products, it is used in beta blocking agents as well as miotics and antiglaucoma preparations. It has been identified in drinking water and water supply. Other recorded sources include electrical and electronic equipment, specifically antennas, electrodes, electrically stimulated smoking devices, and conductors or conductive bodies characterised by the conductive materials. Additionally, it is associated with household cleaning and consumer products, including perfumes within detergents and soaps, tobacco smoke filters, cigar cigarettes, non electric simulated smoking devices, and other smoking requisites. Recorded exposure routes for betaxolol include oral and ophthalmic administration. C18H29NO3 307.4278 307.214743799 1-{4-[2-(cyclopropylmethoxy)ethyl]phenoxy}-3-[(propan-2-yl)amino]propan-2-ol 1-{4-[2-(cyclopropylmethoxy)ethyl]phenoxy}-3-(isopropylamino)propan-2-ol 63659-18-7 CC(C)NCC(O)COC1=CC=C(CCOCC2CC2)C=C1 InChI=1S/C18H29NO3/c1-14(2)19-11-17(20)13-22-18-7-5-15(6-8-18)9-10-21-12-16-3-4-16/h5-8,14,16-17,19-20H,3-4,9-13H2,1-2H3 NWIUTZDMDHAVTP-UHFFFAOYSA-N Organic compounds Benzenoids Phenols Tyrosols and derivatives Tyrosols and derivatives 1,2-aminoalcohols Alkyl aryl ethers Dialkyl ethers Dialkylamines Hydrocarbon derivatives Organopnictogen compounds Phenol ethers Phenoxy compounds Secondary alcohols 1,2-aminoalcohol Alcohol Alkyl aryl ether Amine Aromatic homomonocyclic compound Dialkyl ether Ether Hydrocarbon derivative Monocyclic benzene moiety Organic nitrogen compound Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenol ether Phenoxy compound Secondary alcohol Secondary aliphatic amine Secondary amine Tyrosol derivative Aromatic homomonocyclic compounds propanolamine Detected and Not Quantified Betaxolol Action Pathway SMP0000299 logp 2.54 logp 3.00 ALOGPS logs -4.01 ALOGPS solubility 2.98e-02 g/l ALOGPS logp 2.54 ChemAxon pka_strongest_acidic 14.09 ChemAxon pka_strongest_basic 9.67 ChemAxon iupac 1-{4-[2-(cyclopropylmethoxy)ethyl]phenoxy}-3-[(propan-2-yl)amino]propan-2-ol ChemAxon average_mass 307.4278 ChemAxon mono_mass 307.214743799 ChemAxon smiles CC(C)NCC(O)COC1=CC=C(CCOCC2CC2)C=C1 ChemAxon formula C18H29NO3 ChemAxon inchi InChI=1S/C18H29NO3/c1-14(2)19-11-17(20)13-22-18-7-5-15(6-8-18)9-10-21-12-16-3-4-16/h5-8,14,16-17,19-20H,3-4,9-13H2,1-2H3 ChemAxon inchikey NWIUTZDMDHAVTP-UHFFFAOYSA-N ChemAxon polar_surface_area 50.72 ChemAxon refractivity 88.64 ChemAxon polarizability 37.05 ChemAxon rotatable_bond_count 11 ChemAxon acceptor_count 4 ChemAxon donor_count 2 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bb3d58360> DB00195 2369 2279 BE0000172 BE0000694