1.0 2011-09-21 00:19:04 UTC 2015-10-09 22:31:20 UTC FDB022752 Salbutamol Salbutamol or albuterol is a short-acting beta 2-adrenergic receptor agonist used for the relief of bronchospasm in conditions such as asthma. -- Pubchem [HMDB] (l)-albuterol 1-(tert-butylaminomethyl)-4-hydroxy-m-xylene-alpha1,alpha3-diol 2-(tert-butylamino)-1-(4-hydroxy-3-hydroxymethylphenyl)ethanol 4-hydroxy-3-hydroxymethyl-alpha-((tert-butylamino)methyl)benzyl alcohol Aerolin Albuterol Almotex Alpha'-((tert-butylamino)methyl)-4-hydroxy-m-xylene-alpha,alpha'-diol Alpha(sup 1)-((tert-butylamino)methyl)-4-hydroxy-m-xylene-alpha,alpha'-diol Alti-salbutamol Anebron Arubendol-salbutamol Asmadil Asmanil Asmasal Asmatol Asmaven Asmidon Asmol Asmol uni-dose Asthalin Broncho-spray Broncovaleas Bronter Bugonol Bumol Butamol Buto-asma Butohaler Butotal Butovent Buventol Cobutolin Dilatamol DL-albuterol DL-n-tert-butyl-2-(4-hydroxy-3-hydroxymethylphenyl)-2-hydroxyethylamine DL-salbutamol Farcolin Gerivent Grafalin Levalbuterol Libretin Medolin Mozal Novosalmol Parasma Pneumolat Proventil Proventil hfa Proventil inhaler R-salbutamol Respax Respolin Sabutal Salamol Salbetol Salbron Salbu-basf Salbu-fatol Salbuhexal Salbulin Salbupur Salbusian Salbutalan Salbutamol free base Salbutamol sulfate Salbutamol sulphate Salbutamolum Salbutan Salbutol Salbuven Salbuvent Sallbupp Salmaplon Salomol Salvent Saventol Servitamol Spreor Sultanol Sultanol n Suprasma Suxar Theosal Tobybron Vencronyl Ventamol Ventilan Ventiloboi Ventodisks Ventolin Ventolin inhaler Ventolin rotacaps Ventoline Volare albuterol hfa Volare easi-breathe Volmax Zaperin C13H21NO3 239.3107 239.152143543 4-[(1R)-2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol ventolin 18559-94-9 CC(C)(C)NC[C@H](O)C1=CC(CO)=C(O)C=C1 InChI=1S/C13H21NO3/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15/h4-6,12,14-17H,7-8H2,1-3H3/t12-/m0/s1 NDAUXUAQIAJITI-LBPRGKRZSA-N belongs to the class of organic compounds known as benzyl alcohols. These are organic compounds containing the phenylmethanol substructure. Benzyl alcohols Organic compounds Benzenoids Benzene and substituted derivatives Benzyl alcohols Aromatic homomonocyclic compounds 1,2-aminoalcohols 1-hydroxy-2-unsubstituted benzenoids Aralkylamines Aromatic alcohols Dialkylamines Hydrocarbon derivatives Organopnictogen compounds Primary alcohols Secondary alcohols 1,2-aminoalcohol 1-hydroxy-2-unsubstituted benzenoid Alcohol Amine Aralkylamine Aromatic alcohol Aromatic homomonocyclic compound Benzyl alcohol Hydrocarbon derivative Organic nitrogen compound Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenol Primary alcohol Secondary alcohol Secondary aliphatic amine Secondary amine albuterol Solid logp 0.44 ALOGPS logs -2.05 ALOGPS solubility 2.15e+00 g/l ALOGPS logp 0.34 ChemAxon pka_strongest_acidic 10.12 ChemAxon pka_strongest_basic 9.4 ChemAxon iupac 4-[(1R)-2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol ChemAxon average_mass 239.3107 ChemAxon mono_mass 239.152143543 ChemAxon smiles CC(C)(C)NC[C@H](O)C1=CC(CO)=C(O)C=C1 ChemAxon formula C13H21NO3 ChemAxon inchi InChI=1S/C13H21NO3/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15/h4-6,12,14-17H,7-8H2,1-3H3/t12-/m0/s1 ChemAxon inchikey NDAUXUAQIAJITI-LBPRGKRZSA-N ChemAxon polar_surface_area 72.72 ChemAxon refractivity 67.87 ChemAxon polarizability 26.87 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 4 ChemAxon donor_count 4 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon Specdb::NmrTwoD 1755 Specdb::CMs 7557 Specdb::NmrOneD 1815 Specdb::MsMs 1887 Specdb::MsMs 1888 Specdb::MsMs 1889 Specdb::MsMs 254514 Specdb::MsMs 254515 Specdb::MsMs 254516 Specdb::MsMs 274455 Specdb::MsMs 274456 Specdb::MsMs 274457 HMDB01937 68H #<Reference:0x000055ce331dbe18> #<Reference:0x000055ce331dbc60> Beta-2 adrenergic receptor P07550 ADRB2 Interleukin-8 P10145 IL8