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CAS No.: | 124432-70-8 |
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Name: | 2-Methoxy-3-fluoro-5-bromopyridine |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C6H5BrFNO |
Molecular Weight: | 206.014 |
Synonyms: | 5-Bromo-3-fluoro-2-methoxypyridine; |
Density: | 1.621 g/cm3 |
Boiling Point: | 189.634 °C at 760 mmHg |
Flash Point: | 68.488 °C |
PSA: | 22.12000 |
LogP: | 1.99180 |
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This chemical is called 2-Methoxy-3-fluoro-5-bromopyridine, and it can also be named as 5-Bromo-3-fluoro-2-methoxypyridine. With the molecular formula of C6H5BrFNO, its molecular weight is 206.01. The CAS registry number of this chemical is 124432-70-8, and its product category is Pyridine.
Other characteristics of the 2-Methoxy-3-fluoro-5-bromopyridine can be summarised as followings: (1)ACD/LogP: 2.59; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.59; (4)ACD/LogD (pH 7.4): 2.59; (5)ACD/BCF (pH 5.5): 54.79; (6)ACD/BCF (pH 7.4): 54.79; (7)ACD/KOC (pH 5.5): 611.2; (8)ACD/KOC (pH 7.4): 611.2; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 22.12 Å2; (13)Index of Refraction: 1.521; (14)Molar Refractivity: 38.7 cm3; (15)Molar Volume: 127 cm3; (16)Polarizability: 15.34×10-24cm3; (17)Surface Tension: 38.1 dyne/cm; (18)Density: 1.621 g/cm3; (19)Flash Point: 68.5 °C; (20)Enthalpy of Vaporization: 40.84 kJ/mol; (21)Boiling Point: 189.6 °C at 760 mmHg; (22)Vapour Pressure: 0.78 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Fc1cc(Br)cnc1OC
2.InChI: InChI=1/C6H5BrFNO/c1-10-6-5(8)2-4(7)3-9-6/h2-3H,1H3
3.InChIKey: DEBFRAAJISQBIE-UHFFFAOYAT