The IUPAC name of Salbutamol is 4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol. With the CAS registry number 18559-94-9, it is also named as 1,3-Benzenedimethanol, alpha(sup 1)-(((1,1-dimethylethyl)amino)methyl)-4-hydroxy-. The product's category is Steroids & Hormones - 13C & 2H, and the other registry number is 35763-26-9. Besides, it is white crystalline powder, which is stable, but incompatible with strong oxidizing agents. It is harmful if swallowed. You should wear suitable protective clothing. In addition, its molecular formula is C₁₃H₂₁NO₃ and molecular weight is 239.31.

The other characteristics of this product can be summarized as: (1)EINECS: 242-424-0; (2)ACD/LogP: 0.02; (3)# of Rule of 5 Violations: 0; (4)ACD/LogD (pH 5.5): -3.01; (5)ACD/LogD (pH 7.4): -1.87; (6)ACD/BCF (pH 5.5): 1; (7)ACD/BCF (pH 7.4): 1; (8)ACD/KOC (pH 5.5): 1; (9)ACD/KOC (pH 7.4): 1; (10)#H bond acceptors: 4; (11)#H bond donors: 4; (12)#Freely Rotating Bonds: 8; (13)Index of Refraction: 1.566; (14)Molar Refractivity: 67.76 cm³; (15)Molar Volume: 207.6 cm³; (16)Surface Tension: 49.2 dyne/cm; (17)Density: 1.152 g/cm³; (18)Flash Point: 159.5 °C; (19)Melting Point: 151 °C; (20)Water Solubility: 1.43E+04 mg/L; (21)Enthalpy of Vaporization: 72.67 kJ/mol; (22)Boiling Point: 433.5 °C at 760 mmHg; (23)Vapour Pressure: 2.78E-08 mmHg at 25 °C.

Preparation of Salbutamol: this chemical can be prepared by the reaction as follow.

Uses of Salbutamol: this chemical is a short-acting β2-adrenergic receptor agonist used for the relief of bronchospasm in conditions such as asthma and chronic obstructive pulmonary disease. Similarly, it can react with Propan-2-one to get 2-tert-Butylamino-1-(2,2-dimethyl-4H-benzo[1,3]dioxin-6-yl)-ethanol.



This reaction needs BF₃*OEt₂ at temperature of 0 °C for 1 hour. The yield is 96 %.

People can use the following data to convert to the molecule structure.
(1)SMILES: OCc1cc(ccc1O)C(O)CNC(C)(C)C
(2)InChI: InChI=1/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
(3)InChIKey: NDAUXUAQIAJITI-UHFFFAOYAW

The toxicity data is as follows: