The 3-Bromo-2-chloro-4-iodopyridine, with CAS registry number 884494-53-5, belongs to the following product category: Boronic Acid. It has the systematic name of 3-bromo-2-chloro-4-iodo-pyridine. Its molecular weight is 318.34. And the chemical formula of this chemical is C5H2BrClIN.
Physical properties of 3-Bromo-2-chloro-4-iodopyridine: (1)ACD/LogP: 4.27; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.272; (4)ACD/LogD (pH 7.4): 4.272; (5)ACD/BCF (pH 5.5): 1038.828; (6)ACD/BCF (pH 7.4): 1038.828; (7)ACD/KOC (pH 5.5): 5021.595; (8)ACD/KOC (pH 7.4): 5021.598; (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: 1.674; (14)Molar Refractivity: 49.836 cm3; (15)Molar Volume: 132.865 cm3; (16)Polarizability: 19.757×10-24cm3; (17)Surface Tension: 55.959 dyne/cm; (18)Density: 2.396 g/cm3; (19)Flash Point: 138.819 °C; (20)Enthalpy of Vaporization: 52.458 kJ/mol; (21)Boiling Point: 305.925 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cnc(c(c1I)Br)Cl
(2)InChI: InChI=1/C5H2BrClIN/c6-4-3(8)1-2-9-5(4)7/h1-2H
(3)InChIKey: WYWOYISCYDNWEC-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C5H2BrClIN/c6-4-3(8)1-2-9-5(4)7/h1-2H
(5)Std. InChIKey: WYWOYISCYDNWEC-UHFFFAOYSA-N
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