Quinoline,2,4-dichloro-6-methyl- (102878-18-2)

The 2,4-Dichloro-6-methylquinoline, which is its systematic name and IUPAC name, has the cas registry number of 102878-18-2. Its product belongs to the category of Pharmacetical, and the molecular formula of the chemical is C₁₀H₇Cl₂N.

The characteristics of this chemical are as followings: (1)ACD/LogP: 3.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.88; (4)ACD/LogD (pH 7.4): 3.88; (5)ACD/BCF (pH 5.5): 521.12; (6)ACD/BCF (pH 7.4): 521.12; (7)ACD/KOC (pH 5.5): 3064.68; (8)ACD/KOC (pH 7.4): 3064.68; (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: 1.643; (14)Molar Refractivity: 56.8 cm³; (15)Molar Volume: 156.9 cm³; (16)Polarizability: 22.51×10^-24cm³; (17)Surface Tension: 48.7 dyne/cm; (18)Density: 1.351 g/cm³; (19)Flash Point: 166.7 °C; (20)Enthalpy of Vaporization: 52.33 kJ/mol; (21)Boiling Point: 304.7 °C at 760 mmHg; (22)Vapour Pressure: 0.00155 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Clc1c2cc(ccc2nc(Cl)c1)C
(2)InChI: InChI=1/C10H7Cl2N/c1-6-2-3-9-7(4-6)8(11)5-10(12)13-9/h2-5H,1H3
(3)InChIKey: GLYIJJUSFYXLNF-UHFFFAOYAD