Ethanol,2-[(4-methylphenyl)sulfonyl]- (22381-54-0)

The cas register number of 2-[(4-Methylphenyl)sulfonyl]ethanol is 22381-54-0. It also can be called as 2-Hydroxyethyl 4-methylphenyl sulfone and the IUPAC Name about this chemical is 2-(4-methylphenyl)sulfonylethanol. It belongs to the following product categories, such as Organic Building Blocks, Sulfur Compounds, Tosylates and so on. When you are using it, please avoid contact with skin and eyes.

Physical properties about 2-[(4-Methylphenyl)sulfonyl]ethanol are: (1)ACD/LogP: 0.61; (2)ACD/LogD (pH 5.5): 0.61; (3)ACD/LogD (pH 7.4): 0.61; (4)ACD/BCF (pH 5.5): 1.72; (5)ACD/BCF (pH 7.4): 1.72; (6)ACD/KOC (pH 5.5): 51.38; (7)ACD/KOC (pH 7.4): 51.38; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 51.75Ų; (12)Index of Refraction: 1.544; (13)Molar Refractivity: 50.98 cm³; (14)Molar Volume: 161.4 cm³; (15)Polarizability: 20.21x10^-24cm³; (16)Surface Tension: 45.1 dyne/cm; (17)Enthalpy of Vaporization: 68.11 kJ/mol; (18)Vapour Pressure: 5.73E-07 mmHg at 25°C.

Preparation: this chemical can be prepared by oxirane. This reaction will need reagent montmorillonte clay and solvent H₂O, benzene, acetone. The reaction time is 6 hour(s) at Ambient temperature. The yield is about 78%.

Uses of 2-[(4-Methylphenyl)sulfonyl]ethanol: it can be used to produce p-tolyl-vinyl sulfone at Heating. This reaction will need reagent Et₃N and solvent CH₂Cl₂ with reaction time of 24 hour(s). The yield is about 52%.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)CCO
(2)InChI: InChI=1S/C9H12O3S/c1-8-2-4-9(5-3-8)13(11,12)7-6-10/h2-5,10H,6-7H2,1H3
(3)InChIKey: QJFIXBNLKARINT-UHFFFAOYSA-N