2-Bromo-5-fluorobenzonitrile

The CAS register number of 2-Bromo-5-fluorobenzonitrile is 57381-39-2. It also can be called as Benzonitrile,2-bromo-5-fluoro- and the IUPAC name about this chemical is 2-bromo-5-fluorobenzonitrile. The molecular formula about this chemical is C₇H₃BrFN and the molecular weight is 200.01. It belongs to the following product categories which include Aromatic Nitriles; Nitrile; Bromine Compounds; Fluorine Compounds; Nitriles; Benzenes; C6 to C7; Cyanides/Nitriles; Nitrogen Compounds and so on.

Physical properties about 2-Bromo-5-fluorobenzonitrile are: (1)ACD/LogP: 1.97; (2)ACD/LogD (pH 5.5): 1.97; (3)ACD/LogD (pH 7.4): 1.97; (4)ACD/BCF (pH 5.5): 18.6; (5)ACD/BCF (pH 7.4): 18.6; (6)ACD/KOC (pH 5.5): 282.04; (7)ACD/KOC (pH 7.4): 282.04; (8)#H bond acceptors: 1; (9)Polar Surface Area: 23.79Ų; (10)Index of Refraction: 1.577; (11)Molar Refractivity: 39.15 cm³; (12)Molar Volume: 118 cm³; (13)Polarizability: 15.52x10^-24cm³; (14)Surface Tension: 48.4 dyne/cm; (15)Enthalpy of Vaporization: 48.85 kJ/mol; (16)Boiling Point: 251.2 °C at 760 mmHg; (17)Vapour Pressure: 0.0207 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation, in contact with skin and if swallowed. When you are using it, wear suitable protective clothing. 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: N#Cc1cc(F)ccc1Br
(2)InChI: InChI=1/C7H3BrFN/c8-7-2-1-6(9)3-5(7)4-10/h1-3H
(3)InChIKey: MDHNVHCZDCSTMS-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C7H3BrFN/c8-7-2-1-6(9)3-5(7)4-10/h1-3H
(5)Std. InChIKey: MDHNVHCZDCSTMS-UHFFFAOYSA-N