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Name |
3-Fluoro-2-nitropyridine |
EINECS | N/A |
CAS No. | 54231-35-5 | Density | 1.439 g/cm3 |
PSA | 58.71000 | LogP | 1.65210 |
Solubility | Slightly soluble in water. | Melting Point |
35 °C |
Formula | C5H3FN2O2 | Boiling Point | 255.809 °C at 760 mmHg |
Molecular Weight | 142.089 | Flash Point | 108.51 °C |
Transport Information | N/A | Appearance | light brown crystal powder or liquid |
Safety | 36/37/39-45-24/25 | Risk Codes | 34 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
2-Nitro-3-fluoropyridine; |
Article Data | 4 |
The 3-Fluoro-2-nitropyridine, with the CAS registry number 54231-35-5, is also known as Pyridine, 3-fluoro-2-nitro-. It belongs to the product categories of Nitro; Miscellaneous; Pyridine Series; Halides; Pyridines; Pyridine; Chiral Chemicals. This chemical's molecular formula is C5H3FN2O2 and molecular weight is 142.09. What's more, its IUPAC name is the same with its product name. When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes.
Physical properties about 3-Fluoro-2-nitropyridine are: (1)ACD/LogP: 0.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.39; (4)ACD/LogD (pH 7.4): 0.39; (5)ACD/BCF (pH 5.5): 1.17; (6)ACD/BCF (pH 7.4): 1.17; (7)ACD/KOC (pH 5.5): 38.85; (8)ACD/KOC (pH 7.4): 38.85; (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: 1.538; (14)Molar Refractivity: 30.883 cm3; (15)Molar Volume: 98.709 cm3; (16)Polarizability: 12.243×10-24cm3; (17)Surface Tension: 51.191 dyne/cm; (18)Density: 1.439 g/cm3; (19)Flash Point: 108.51 °C; (20)Enthalpy of Vaporization: 47.336 kJ/mol; (21)Boiling Point: 255.809 °C at 760 mmHg; (22)Vapour Pressure: 0.0260 mmHg at 25 °C.
Uses of 3-Fluoro-2-nitropyridine: it is used to produce other chemicals. For example, it can react with benzoic acid hydrazide to get 3-(2-benzoylhydrazino)-2-nitropyridine. The reaction occurs with reagent ethanol and other condition of heating for 16 hours. The yield is 77 %.
You can still convert the following datas into molecular structure:
(1) SMILES: c1cc(c(nc1)[N+](=O)[O-])F
(2) InChI: InChI=1S/C5H3FN2O2/c6-4-2-1-3-7-5(4)8(9)10/h1-3H
(3) InChIKey: IJVFHCSUEBAAOZ-UHFFFAOYSA-N