The 2,3,5-Trimethyl-6-bromopyridine is an organic compound with the formula C8H10BrN. The systematic name of this chemical is 2-bromo-3,5,6-trimethyl-pyridine. With the CAS registry number 34595-91-0, it is also named as Pyridine, 2-bromo-3,5,6-trimethyl-.
Physical properties about 2,3,5-Trimethyl-6-bromopyridine are: (1)ACD/LogP: 3.02 ; (2)ACD/LogD (pH 5.5): 3.015; (3)ACD/LogD (pH 7.4): 3.015; (4)ACD/BCF (pH 5.5): 115.092; (5)ACD/BCF (pH 7.4): 115.136; (6)ACD/KOC (pH 5.5): 1039.576; (7)ACD/KOC (pH 7.4): 1039.979; (8)#H bond acceptors: 1; (9)Polar Surface Area: 12.89 Å2; (10)Index of Refraction: 1.542; (11)Molar Refractivity: 46.509 cm3; (12)Molar Volume: 147.667 cm3; (13)Polarizability: 18.438×10-24cm3; (14)Surface Tension: 37.267 dyne/cm; (15)Density: 1.355 g/cm3; (16)Flash Point: 108.149 °C; (17)Enthalpy of Vaporization: 47.277 kJ/mol; (18)Boiling Point: 255.212 °C at 760 mmHg; (19)Vapour Pressure: 0.026 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cc(c(nc1C)Br)C
(2)InChI: InChI=1/C8H10BrN/c1-5-4-6(2)8(9)10-7(5)3/h4H,1-3H3
(3)InChIKey: NYNUMXQYOLVYNK-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C8H10BrN/c1-5-4-6(2)8(9)10-7(5)3/h4H,1-3H3
(5)Std. InChIKey: NYNUMXQYOLVYNK-UHFFFAOYSA-N
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