Benzene,4-chloro-2-fluoro-1-iodo- (6797-79-1)

The 4-Chloro-2-fluoroiodobenzene with the cas number 6797-79-1 is also called Benzene,4-chloro-2-fluoro-1-iodo-. Both the systematic name and IUPAC name are 4-chloro-2-fluoro-1-iodobenzene. Its molecular formula is C₆H₃ClFI. This chemical belongs to the following product categories: (1)Chlorine Compounds; (2)Fluorine Compounds; (3)Iodine Compounds; (4)Aryl; (5)C6; (6)Halogenated Hydrocarbons.

The properties of the chemical are: (1)ACD/LogP: 3.30; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.3; (4)ACD/LogD (pH 7.4): 3.3; (5)ACD/BCF (pH 5.5): 188.87; (6)ACD/BCF (pH 7.4): 188.87; (7)ACD/KOC (pH 5.5): 1482.1; (8)ACD/KOC (pH 7.4): 1482.1; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.606; (14)Molar Refractivity: 44.04 cm³; (15)Molar Volume: 127.6 cm³; (16)Polarizability: 17.46×10^-24cm³; (17)Surface Tension: 42.4 dyne/cm; (18)Enthalpy of Vaporization: 43.72 kJ/mol; (19)Vapour Pressure: 0.177 mmHg at 25°C.

While using this chemical, you should be very cautious. This chemical is not only irritating to skin, but also irritating to eyes and respiratory system. Therefore, you should take the following instructions. Firstly, you should wear suitable protective clothing. Then in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc(Cl)ccc1I
(2)InChI: InChI=1/C6H3ClFI/c7-4-1-2-6(9)5(8)3-4/h1-3H
(3)InChIKey: RSTFBOIFYXJIMR-UHFFFAOYAR