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| CAS No.: | 19346-46-4 |
|---|---|
| Name: | 2-FLUORO-5-NITRO-3-PICOLINE |
| Article Data: | 3 |
| Molecular Structure: | |
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| Formula: | C6H5FN2O2 |
| Molecular Weight: | 156.11 |
| Synonyms: | 3-Picoline,2-fluoro-5-nitro- (8CI);2-Fluoro-5-nitro-3-methylpyridine;2-Fluoro-5-nitro-3-picoline; |
| Density: | 1.358 g/cm3 |
| Boiling Point: | 265.667 °C at 760 mmHg |
| Flash Point: | 114.472 °C |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 58.71000 |
| LogP: | 1.96050 |
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Specification
The 2-Fluoro-3-methyl-5-nitropyridine, with the CAS registry number 19346-46-4, is also known as Pyridine, 2-fluoro-3-methyl-5-nitro-. It belongs to the product categories of Pyridine; Pyridines; Boronic Acid. This chemical's molecular formula is C6H5FN2O2 and molecular weight is 156.11. What's more, its IUPAC name is the same with product name.
Physical properties about 2-Fluoro-3-methyl-5-nitropyridine are: (1)ACD/LogP: 1.018; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.02; (4)ACD/LogD (pH 7.4): 1.02; (5)ACD/BCF (pH 5.5): 3.50; (6)ACD/BCF (pH 7.4): 3.5 ; (7)ACD/KOC (pH 5.5): 85.26; (8)ACD/KOC (pH 7.4): 85.26; (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: 47.38 dyne/cm; (18)Density: 1.358 g/cm3; (19)Flash Point: 114.472 °C; (20)Enthalpy of Vaporization: 48.33 kJ/mol; (21)Boiling Point: 265.667 °C at 760 mmHg; (22)Vapour Pressure: 0.015 mmHg at 25 °C
When you are dealing with this chemical, you should be very careful. This chemical is inflammation to the skin, eyes and respiratory system or other mucous membranes. Therefore, you should wear suitable protective clothing. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1) SMILES: Cc1cc(cnc1F)N(=O)=O
(2) InChI: InChI=1S/C6H5FN2O2/c1-4-2-5(9(10)11)3-8-6(4)7/h2-3H,1H3
(3) InChIKey: CFKHKTLGKNBEPI-UHFFFAOYSA-N