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| CAS No.: | 209328-87-0 |
|---|---|
| Name: | 2-FLUORO-3-HYDROXY-6-PICOLINE |
| Molecular Structure: | |
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| Formula: | C6H6FNO |
| Molecular Weight: | 127.118 |
| Synonyms: | 2-Fluoro-3-hydroxy-6-methylpyridine; |
| Density: | 1.252 g/cm3 |
| Boiling Point: | 289.4 °C at 760 mmHg |
| Flash Point: | 128.8 °C |
| PSA: | 33.12000 |
| LogP: | 1.23470 |
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Specification
The 3-Pyridinol,2-fluoro-6-methyl-, with CAS registry number 209328-87-0, belongs to the following product categories: (1)Pyridines; (2)Boronic Acid. It has the systematic name of 2-fluoro-6-methylpyridin-3-ol. Besides this, it is also called 2-Fluoro-3-hydroxy-6-picoline. And the chemical formula of this chemical is C6H6FNO.
Physical properties of 3-Pyridinol,2-fluoro-6-methyl-: (1)ACD/LogP: 1.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.38; (4)ACD/LogD (pH 7.4): 1.08; (5)ACD/BCF (pH 5.5): 6.59; (6)ACD/BCF (pH 7.4): 3.29; (7)ACD/KOC (pH 5.5): 133.78; (8)ACD/KOC (pH 7.4): 66.77; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 33.12 Å2; (13)Index of Refraction: 1.523; (14)Molar Refractivity: 31.04 cm3; (15)Molar Volume: 101.5 cm3; (16)Polarizability: 12.3×10-24cm3; (17)Surface Tension: 43.7 dyne/cm; (18)Density: 1.251 g/cm3; (19)Flash Point: 128.8 °C; (20)Enthalpy of Vaporization: 54.99 kJ/mol; (21)Boiling Point: 289.4 °C at 760 mmHg; (22)Vapour Pressure: 0.00127 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1ccc(O)c(F)n1
(2)InChI: InChI=1/C6H6FNO/c1-4-2-3-5(9)6(7)8-4/h2-3,9H,1H3
(3)InChIKey: XRIQUMOZVIWTBI-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C6H6FNO/c1-4-2-3-5(9)6(7)8-4/h2-3,9H,1H3
(5)Std. InChIKey: XRIQUMOZVIWTBI-UHFFFAOYSA-N