Name: 2-Fluoro-6-(difluoromethoxy)pyridine
SKU: 947534-62-5

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Basic Information

Molecular Structure:
CAS No.:	947534-62-5
Name:	2-Fluoro-6-(difluoromethoxy)pyridine

Formula:	C₆H₄F₃NO
Molecular Weight:	163.10
Synonyms:	pyridine, 2-(difluoromethoxy)-6-fluoro-;
Density:	1.335 g/cm³
Boiling Point:	138.665 °C at 760 mmHg
Flash Point:	37.664 °C
PSA:	22.12000
LogP:	1.82210

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Specification

The 2-Fluoro-6-(difluoromethoxy)pyridine with the cas number 947534-62-5 is also called pyridine, 2-(difluoromethoxy)-6-fluoro-. Both the systematic name and IUPAC name are 2-(difluoromethoxy)-6-fluoropyridine. Its molecular formula is C₆H₄F₃NO. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 2.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.038; (4)ACD/LogD (pH 7.4): 2.038; (5)ACD/BCF (pH 5.5): 20.839; (6)ACD/BCF (pH 7.4): 20.839; (7)ACD/KOC (pH 5.5): 305.964; (8)ACD/KOC (pH 7.4): 305.964; (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: 1.426; (14)Molar Refractivity: 31.303 cm³; (15)Molar Volume: 122.141 cm³; (16)Polarizability: 12.409×10^-24cm³; (17)Surface Tension: 28.26 dyne/cm ; (18)Enthalpy of Vaporization: 36.044 kJ/mol; (19)Vapour Pressure: 8.282 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(nc(c1)F)OC(F)F
(2)InChI: InChI=1/C6H4F3NO/c7-4-2-1-3-5(10-4)11-6(8)9/h1-3,6H
(3)InChIKey: IACWJJQKDUBNHE-UHFFFAOYAJ