The 3-Pyridinemethanol,2-chloro-5-fluoro-, with CAS registry number 870063-52-8, belongs to the following product category: Boronic Acid. It has the systematic name of (2-chloro-5-fluoro-3-pyridyl)methanol. Its molecular weight is 161.56. And the chemical formula of this chemical is C6H5ClFNO.
Physical properties of 3-Pyridinemethanol,2-chloro-5-fluoro-: (1)ACD/LogP: 0.21; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.21; (4)ACD/LogD (pH 7.4): 0.21; (5)#H bond acceptors: 2; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 33.12 Å2; (9)Index of Refraction: 1.546; (10)Molar Refractivity: 35.68 cm3; (11)Molar Volume: 112.6 cm3; (12)Polarizability: 14.14×10-24cm3; (13)Surface Tension: 48.9 dyne/cm; (14)Density: 1.434 g/cm3; (15)Flash Point: 107.2 °C; (16)Enthalpy of Vaporization: 51.88 kJ/mol; (17)Boiling Point: 253.6 °C at 760 mmHg; (18)Vapour Pressure: 0.00942 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: OCc1cc(F)cnc1Cl
(2)InChI: InChI=1/C6H5ClFNO/c7-6-4(3-10)1-5(8)2-9-6/h1-2,10H,3H2
(3)InChIKey: FYHQEGIVKQGQHC-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C6H5ClFNO/c7-6-4(3-10)1-5(8)2-9-6/h1-2,10H,3H2
(5)Std. InChIKey: FYHQEGIVKQGQHC-UHFFFAOYSA-N
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