Ethanone,2-bromo-1-(2,4-difluorophenyl)- (102429-07-2)

The 2-Bromo-2',4'-difluoroacetophenone with cas registry number of 102429-07-2 belongs to categories of Benzene series; C7 to C8; Carbonyl Compounds; Ketones. This chemical is also known as 2,4-Difluorophenacyl bromide. Its systematic name is named as 2-bromo-1-(2,4-difluorophenyl)ethanone.

Physical properties about this chemical are: (1)ACD/LogP: 1.91; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.91; (4)ACD/LogD (pH 7.4): 1.91; (5)ACD/BCF (pH 5.5): 16.73; (6)ACD/BCF (pH 7.4): 16.73; (7)ACD/KOC (pH 5.5): 261.46; (8)ACD/KOC (pH 7.4): 261.46; (9)#H bond acceptors: 1; (10)#H bond donors: 0 ; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.529; (14)Molar Refractivity: 44 cm³; (15)Molar Volume: 142.5 cm³; (16)Surface Tension: 40.1 dyne/cm; (17)Density: 1.648 g/cm³; (18)Flash Point: 102.6 °C ; (19)Enthalpy of Vaporization: 48.32 kJ/mol ; (20)Boiling Point: 246.1 °C at 760 mmHg ; (21)Vapour Pressure: 0.0276 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is sensitive to lachrymatory. It is highly flammable. Keep away from sources of ignition - No smoking. It is harmful if swallowed. It also can cause burns. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you feel unwell, seek medical advice immediately.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccc(F)cc1F)CBr;
(2)InChI: InChI=1/C8H5BrF2O/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3H,4H2;
(3)InChIKey: CSGDTHXBRAAOHV-UHFFFAOYA