1-Chloro-2-iodobenzene

The Benzene,1-chloro-2-iodo-, with CAS registry number 615-41-8, belongs to the following product categories: (1)Chlorine Compounds; (2)Iodine Compounds. It has the systematic name of 1-chloro-2-iodo-benzene. This chemical is a kind of clear colourless to light yellow liquid. What's more, its EINECS is 210-423-4.

Physical properties of Benzene,1-chloro-2-iodo-: (1)ACD/LogP: 4.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.1; (4)ACD/LogD (pH 7.4): 4.1; (5)#H bond acceptors: 0; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 0; (8)Index of Refraction: 1.632; (9)Molar Refractivity: 44.05 cm³; (10)Molar Volume: 123.4 cm³; (11)Polarizability: 17.46×10^-24cm³; (12)Surface Tension: 44.4 dyne/cm; (13)Enthalpy of Vaporization: 45.21 kJ/mol; (14)Vapour Pressure: 0.0805 mmHg at 25°C.

Preparation: this chemical can be prepared by 2-chloro-aniline. This reaction will need reagents NaNO₂, hexamethyldisilane, iodine, benzyltriethylammonium chloride and solvent CCl₄. The yield is about 81%.

Uses of Benzene,1-chloro-2-iodo-: it can be used to produce 2,2'-dichloro-biphenyl. This reaction will need reagent copper powder. The reaction temperature is 220 - 290 ℃.

When you are using this chemical, please be cautious about it as the following:
The Trimesic acid irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection and avoid contact with skin and eyes. 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: Ic1ccccc1Cl
(2)InChI: InChI=1/C6H4ClI/c7-5-3-1-2-4-6(5)8/h1-4H
(3)InChIKey: MPEOPBCQHNWNFB-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C6H4ClI/c7-5-3-1-2-4-6(5)8/h1-4H
(5)Std. InChIKey: MPEOPBCQHNWNFB-UHFFFAOYSA-N