The Pyridine, 2-bromo-6-(1-methylethoxy)-, with the CAS registry number 463336-87-0, is also known as 2-Bromo-6-(isopropyloxy)pyridine. This chemical's molecular formula is C8H10BrNO and molecular weight is 216.07. What's more, its systematic name is 2-Bromo-6-(propan-2-yloxy)pyridine.
Physical properties about Pyridine, 2-bromo-6-(1-methylethoxy)- are: (1)ACD/LogP: 3.30; (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): 140; (6)ACD/BCF (pH 7.4): 140; (7)ACD/KOC (pH 5.5): 1197; (8)ACD/KOC (pH 7.4): 1197; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 22.12 Å2; (13)Index of Refraction: 1.526; (14)Molar Refractivity: 47.937 cm3; (15)Molar Volume: 156.234 cm3; (16)Polarizability: 19.004×10-24 cm3; (17)Surface Tension: 37.083 dyne/cm; (18)Density: 1.383 g/cm3; (19)Flash Point: 96.395 °C; (20)Enthalpy of Vaporization: 45.338 kJ/mol; (21)Boiling Point: 235.778 °C at 760 mmHg; (22)Vapour Pressure: 0.075 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Brc1cccc(OC(C)C)n1
(2) InChI: InChI=1/C8H10BrNO/c1-6(2)11-8-5-3-4-7(9)10-8/h3-6H,1-2H3
(3) InChIKey: RBQOILDHZGNUQT-UHFFFAOYAP
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