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| CAS No.: | 19346-45-3 |
|---|---|
| Name: | 2-Fluoro-6-methyl-3-nitropyridine |
| Article Data: | 2 |
| Molecular Structure: | |
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| Formula: | C6H5FN2O2 |
| Molecular Weight: | 156.116 |
| Synonyms: | 2-Picoline,6-fluoro-5-nitro- (8CI);2-Fluoro-3-nitro-6-methylpyridine;2-Fluor-6-methyl-3-nitropyridin;Pyridine, 2-fluoro-6-methyl-3-nitro-;2-Fluoro-3-Nitro-6-Methylpyridine; |
| EINECS: | 251-156-6 |
| Density: | 1.358 g/cm3 |
| Melting Point: | 30℃ |
| Boiling Point: | 266.236 °C at 760 mmHg |
| Flash Point: | 114.816 °C |
| Solubility: | Slightly soluble in water. |
| Hazard Symbols: | Xn |
| Risk Codes: | 22 |
| PSA: | 58.71000 |
| LogP: | 1.96050 |
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Specification
The 2-Fluoro-6-methyl-3-nitropyridine, with the CAS registry number 19346-45-3, is also known as 2-Fluoro-3-Nitro-6-Methylpyridine. It belongs to the following product categories: Pyridine; Pyridines; Boronic Acid. And the molecular formula of this chemical is C6H5FN2O2.
The physical properties of 2-Fluoro-6-methyl-3-nitropyridine are as following: (1)ACD/LogP: 1.02; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.017; (4)ACD/LogD (pH 7.4): 1.017; (5)ACD/BCF (pH 5.5): 3.488; (6)ACD/BCF (pH 7.4): 3.488; (7)ACD/KOC (pH 5.5): 85.123; (8)ACD/KOC (pH 7.4): 85.123; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 58.71 Å2; (13)Index of Refraction: 1.533; (14)Molar Refractivity: 35.708 cm3; (15)Molar Volume: 114.984 cm3; (16)Polarizability: 14.156×10-24cm3; (17)Surface Tension: 47.382 dyne/cm; (18)Density: 1.358 g/cm3; (19)Flash Point: 114.816 °C; (20)Enthalpy of Vaporization: 48.388 kJ/mol; (21)Boiling Point: 266.236 °C at 760 mmHg; (22)Vapour Pressure: 0.014 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1ccc(c(n1)F)N(=O)=O
(2)InChI: InChI=1/C6H5FN2O2/c1-4-2-3-5(9(10)11)6(7)8-4/h2-3H,1H3
(3)InChIKey: BCCWOQXQVNCXKC-UHFFFAOYAW