1-BROMO-2-FLUORO-4-IODOBENZENE

The Benzene,1-bromo-2-fluoro-4-iodo-, with CAS registry number 136434-77-0, belongs to the following product categories: (1)Aromatic Halides (substituted); (2)API intermediates; (3)Miscellaneous; (4)Bromine Compounds; (5)Fluorine Compounds; (6)Iodine Compounds; (7)Aryl; (8)C6; (9)Halogenated Hydrocarbons. It has the systematic name of 1-bromo-2-fluoro-4-iodobenzene. This chemical is a kind of pale brown crystalline low melting solid.

Physical properties of Benzene,1-bromo-2-fluoro-4-iodo-: (1)ACD/LogP: 3.92; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.92; (4)ACD/LogD (pH 7.4): 3.92; (5)ACD/BCF (pH 5.5): 562.71; (6)ACD/BCF (pH 7.4): 562.71; (7)ACD/KOC (pH 5.5): 3237.86; (8)ACD/KOC (pH 7.4): 3237.86; (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: 1.628; (14)Molar Refractivity: 46.84 cm³; (15)Molar Volume: 131.9 cm³; (16)Polarizability: 18.57×10^-24cm³; (17)Surface Tension: 44.4 dyne/cm; (18)Enthalpy of Vaporization: 45.61 kJ/mol; (19)Vapour Pressure: 0.0651 mmHg at 25°C.

Uses of Benzene,1-bromo-2-fluoro-4-iodo-: it can be used to produce 3-Bromo-2-fluoro-6-iodobenzoic acid. This reaction will need reagent LDA and solvent tetrahydrofuran. The yield is about 77%.

When you are using this chemical, please be cautious about it as the following:
The Benzene,1-bromo-2-fluoro-4-iodo- is harmful if swallowed and it is harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment. This chemical 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.

You can still convert the following datas into molecular structure:
(1)SMILES: Ic1ccc(Br)c(F)c1
(2)InChI: InChI=1/C6H3BrFI/c7-5-2-1-4(9)3-6(5)8/h1-3H
(3)InChIKey: OCODJNASCDFXSR-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C6H3BrFI/c7-5-2-1-4(9)3-6(5)8/h1-3H
(5)Std. InChIKey: OCODJNASCDFXSR-UHFFFAOYSA-N