6-CHLORO-2-METHYLQUINOLINE

The Quinoline,6-chloro-2-methyl-, with the CAS registry number 92-46-6, has the systematic name of 6-chloro-2-methylquinoline. It belongs to the following product categories: Building Blocks; Halogenated Heterocycles; Heterocyclic Building Blocks; Quinolines; QuinolinesHeterocyclic Building Blocks. And the molecular formula of the chemical is C₁₀H₈ClN.

The characteristics of Quinoline,6-chloro-2-methyl- are as followings: (1)ACD/LogP: 3.19; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.07; (4)ACD/LogD (pH 7.4): 3.19; (5)ACD/BCF (pH 5.5): 117.47; (6)ACD/BCF (pH 7.4): 155.83; (7)ACD/KOC (pH 5.5): 972.48; (8)ACD/KOC (pH 7.4): 1290; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89 Å²; (13)Index of Refraction: 1.634; (14)Molar Refractivity: 51.9 cm³; (15)Molar Volume: 144.9 cm³; (16)Polarizability: 20.57×10^-24cm³; (17)Surface Tension: 46.5 dyne/cm; (18)Density: 1.225 g/cm³; (19)Flash Point: 148.7 °C; (20)Enthalpy of Vaporization: 49.6 kJ/mol; (21)Boiling Point: 278.2 °C at 760 mmHg; (22)Vapour Pressure: 0.00732 mmHg at 25°C. 

Preparation of Quinoline,6-chloro-2-methyl-: This chemical can be prepared by propan-2-one and 5-chloro-2-nitro-benzaldehyde. The reaction will need reagent Li^.4.5 THF, and menstruum methanol. The reaction time is 160 hours with temperature of 20-25°C, and the yield is about 87%. 

Uses of Quinoline,6-chloro-2-methyl-: It can react with benzoic acid methyl ester to produce 1-Phenyl-2-(6-chloro-2-quinolyl)ethanone. This reaction will need reagent NaH, and the menstruum toluene. And the yield is about 39%.

You should be cautious while dealing with this chemical. It irritates to respiratory system and skin, and may cause serious damage to eyes. It is also harmful if swallowed. Therefore, you had better take the following instructions: Wear suitable eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.   

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Clc1ccc2nc(ccc2c1)C
(2)InChI: InChI=1/C10H8ClN/c1-7-2-3-8-6-9(11)4-5-10(8)12-7/h2-6H,1H3
(3)InChIKey: OCCIBGIEIBQGAJ-UHFFFAOYAQ