3-CHLOROBENZAL CHLORIDE

The Benzene,1-chloro-3-(dichloromethyl)-, with the CAS registry number 15145-69-4, is also known as α,α,3-Trichlorotoluene. Its EINECS number is 239-206-2. This chemical's molecular formula is C₇H₅Cl₃ and molecular weight is 195.47. Its systematic name is called 1-chloro-3-(dichloromethyl)benzene. This chemical is clear colorless to slightly yellow liquid. You should keep container tightly closed and in a well-ventilated place.

Physical properties of Benzene,1-chloro-3-(dichloromethyl)-: (1)ACD/LogP: 3.24; (2)ACD/LogD (pH 5.5): 3.24; (3)ACD/LogD (pH 7.4): 3.24; (4)ACD/BCF (pH 5.5): 171.24; (5)ACD/BCF (pH 7.4): 171.24; (6)ACD/KOC (pH 5.5): 1381.74; (7)ACD/KOC (pH 7.4): 1381.74; (8)#Freely Rotating Bonds: 1; (9)Index of Refraction: 1.561; (10)Molar Refractivity: 45.76 cm³; (11)Molar Volume: 141.2 cm³; (12)Surface Tension: 40.1 dyne/cm; (13)Density: 1.384 g/cm³; (14)Flash Point: 145.2 °C; (15)Enthalpy of Vaporization: 45.12 kJ/mol; (16)Boiling Point: 233.6 °C at 760 mmHg; (17)Vapour Pressure: 0.0844 mmHg at 25°C.

Preparation: this chemical can be prepared by 3-chloro-benzaldehyde. This reaction will need reagent PCl₅.

When you are using this chemical, please be cautious about it as the following:
This chemical may destroy living tissue on contact and may cause burns. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: ClC(Cl)c1cc(Cl)ccc1
(2)InChI: InChI=1/C7H5Cl3/c8-6-3-1-2-5(4-6)7(9)10/h1-4,7H
(3)InChIKey: ACNQJGLSENYFQJ-UHFFFAOYAN