Benzene,1-bromo-2,3,4,5-tetrafluoro- (1074-91-5)

The 1-Bromo-2,3,4,5-tetrafluorobenzene is an organic compound with the formula C₆HBrF₄. The systematic/IUPAC name of this chemical is 1-bromo-2,3,4,5-tetrafluorobenzene. With the CAS registry number 1074-91-5, it is also named as 2,3,4,5-Tetrafluorobromobenzene. The product's categories are Aryl; C6; Halogenated Hydrocarbons. Besides, it is a colorless transparent liquid, which should be stored at room temperature.

Physical properties about 1-Bromo-2,3,4,5-tetrafluorobenzene are: (1)ACD/LogP: 2.90; (2)ACD/LogD (pH 5.5): 2.9; (3)ACD/LogD (pH 7.4): 2.9; (4)ACD/BCF (pH 5.5): 93.78; (5)ACD/BCF (pH 7.4): 93.78; (6)ACD/KOC (pH 5.5): 897.96; (7)ACD/KOC (pH 7.4): 897.96; (8)Index of Refraction: 1.466; (9)Molar Refractivity: 33.91 cm³; (10)Molar Volume: 122.4 cm³; (11)Polarizability: 13.44×10^-24cm³; (12)Surface Tension: 29.8 dyne/cm; (13)Density: 1.869 g/cm³; (14)Flash Point: 54.6 °C; (15)Enthalpy of Vaporization: 36.84 kJ/mol; (16)Boiling Point: 147.3 °C at 760 mmHg; (17)Vapour Pressure: 5.65 mmHg at 25°C.

Preparation: this chemical can be prepared by 1,2-dibromo-3,4,5,6-tetrafluorobenzene. This reaction will need solvent Zn and AcOH by heating.

Uses of 1-Bromo-2,3,4,5-tetrafluorobenzene: it can be used to produce 1.2.3.4-Tetrafluor-5-phenylmercaptobenzol by heating. It will need solvent dimethylformamide  with reaction time of 23 hours. The yield is about 77%.

When you are using this chemical, please be cautious about it as the following:
It is Flammable. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection, and keep away from sources of ignition - No smoking . In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1c(F)c(F)cc(Br)c1F
(2)InChI: InChI=1/C6HBrF4/c7-2-1-3(8)5(10)6(11)4(2)9/h1H
(3)InChIKey: BUYSIDPAOVWMQX-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C6HBrF4/c7-2-1-3(8)5(10)6(11)4(2)9/h1H
(5)Std. InChIKey: BUYSIDPAOVWMQX-UHFFFAOYSA-N