4-(1,1,2,2-Tetrafluoroethoxy)toluene

The 4-(1,1,2,2-Tetrafluoroethoxy)toluene, with CAS registry number 1737-11-7, has the systematic name of 1-methyl-4-(1,1,2,2-tetrafluoroethoxy)benzene. And its IUPAC name is the same one. Besides this, it is also called Benzene, 1-methyl-4-(1,1,2,2-tetrafluoroethoxy)-.

Physical properties about this chemical are: (1)ACD/LogP: 3.86; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.86; (4)ACD/LogD (pH 7.4): 3.86; (5)ACD/BCF (pH 5.5): 502.11; (6)ACD/BCF (pH 7.4): 502.11; (7)ACD/KOC (pH 5.5): 2984.24; (8)ACD/KOC (pH 7.4): 2984.24; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.423; (14)Molar Refractivity: 42.96 cm³; (15)Molar Volume: 168.4 cm³; (16)Polarizability: 17.03×10^-24cm³; (17)Surface Tension: 23.7 dyne/cm; (18)Enthalpy of Vaporization: 40.16 kJ/mol; (19)Vapour Pressure: 1.1 mmHg at 25°C.

Uses of 4-(1,1,2,2-Tetrafluoroethoxy)toluene: it can be used to produce a,a,b,b-tetrafluoro-p-methylphenetole. This reaction will need reagent KF and solvent dimethylsulfoxide. The reaction time is 5 hour(s) with reaction temperature of 120 - 130 ℃. The yield is about 50%.

When you are using this chemical, please be cautious about it as the following:
The 4-(1,1,2,2-Tetrafluoroethoxy)toluene irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides this, this chemical is harmful by inhalation, in contact with skin and if swallowed.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(Oc1ccc(cc1)C)C(F)F
(2)InChI: InChI=1/C9H8F4O/c1-6-2-4-7(5-3-6)14-9(12,13)8(10)11/h2-5,8H,1H3
(3)InChIKey: VACIXOPZIXUAKS-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C9H8F4O/c1-6-2-4-7(5-3-6)14-9(12,13)8(10)11/h2-5,8H,1H3
(5)Std. InChIKey: VACIXOPZIXUAKS-UHFFFAOYSA-N