The 6-Bromo-2-methoxyquinoline, with the CAS registry number 99455-05-7, is also known as has the molecular formula C10H8BrNO, besides, its molecular weight is 238.0806. Its systematic name is called 6-bromo-2-methoxyquinoline.
Physical properties of 6-Bromo-2-methoxyquinoline: (1)ACD/LogP: 3.90; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 72; (6)ACD/BCF (pH 7.4): 72; (7)ACD/KOC (pH 5.5): 742; (8)ACD/KOC (pH 7.4): 742; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.64; (13)Molar Refractivity: 56.555 cm3; (14)Molar Volume: 156.96 cm3; (15)Surface Tension: 47.665 dyne/cm; (16)Density: 1.517 g/cm3; (17)Flash Point: 142.877 °C; (18)Enthalpy of Vaporization: 53.157 kJ/mol; (19)Boiling Point: 312.635 °C at 760 mmHg; (20)Vapour Pressure: 0.001 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccc2nc(OC)ccc2c1
(2)InChI: InChI=1/C10H8BrNO/c1-13-10-5-2-7-6-8(11)3-4-9(7)12-10/h2-6H,1H3
(3)InChIKey: KBTKKEMYFUMFSJ-UHFFFAOYAE
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