The 2,2':6',2''-Terpyridine,4'-bromo-, with the CAS registry number 149817-62-9, is also known as ZINC26898843. It belongs to the product categories of Pharmacetical. This chemical's molecular formula is C15H10BrN3 and molecular weight is 312.16. Its IUPAC name is called 4-bromo-2,6-dipyridin-2-ylpyridine.
Physical properties of 2,2':6',2''-Terpyridine,4'-bromo-: (1)ACD/LogP: 2.78; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 3; (4)ACD/BCF (pH 5.5): 70; (5)ACD/BCF (pH 7.4): 73; (6)ACD/KOC (pH 5.5): 721; (7)ACD/KOC (pH 7.4): 751; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.636; (11)Molar Refractivity: 77.401 cm3; (12)Molar Volume: 215.859 cm3; (13)Surface Tension: 54.659 dyne/cm; (14)Density: 1.446 g/cm3; (15)Flash Point: 209.173 °C; (16)Enthalpy of Vaporization: 65.02 kJ/mol; (17)Boiling Point: 422.256 °C at 760 mmHg; (18)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1ccnc(c1)c2cc(cc(n2)c3ccccn3)Br
(2)InChI: InChI=1/C15H10BrN3/c16-11-9-14(12-5-1-3-7-17-12)19-15(10-11)13-6-2-4-8-18-13/h1-10H
(3)InChIKey: CJRRILXBSCRHKN-UHFFFAOYAI
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