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| CAS No.: | 228410-90-0 |
|---|---|
| Name: | 5-BROMO-2-HYDROXY-3-NITRO-4-PICOLINE |
| Molecular Structure: | |
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|
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| Formula: | C6H5BrN2O3 |
| Molecular Weight: | 233.021 |
| Synonyms: | 5-Bromo-2-hydroxy-4-methyl-3-nitropyridine; |
| Density: | 1.84 g/cm3 |
| Melting Point: | 240-243 °C |
| Boiling Point: | 298.2 °C at 760 mmHg |
| Flash Point: | 134.1 °C |
| Hazard Symbols: |
 Xi
|
| PSA: | 78.94000 |
| LogP: | 2.28950 |
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Specification
The 2(1H)-Pyridinone,5-bromo-4-methyl-3-nitro-, with the CAS registry number 228410-90-0, is also known as 5-Bromo-2-hydroxy-4-methyl-3-nitropyridine 98%. It belongs to the product categories of Blocks; Bromides; Pyridines; Pyridine; API intermediates. This chemical's molecular formula is C6H5BrN2O3 and molecular weight is 233.0195. Its systematic name is called 5-bromo-4-methyl-3-nitropyridin-2(1H)-one. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.
Physical properties of 2(1H)-Pyridinone,5-bromo-4-methyl-3-nitro-: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 18.63; (4)ACD/KOC (pH 7.4): 2.48; (5)#H bond acceptors: 5; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 1; (8)Index of Refraction: 1.62; (9)Molar Refractivity: 44.44 cm3; (10)Molar Volume: 126.4 cm3; (11)Surface Tension: 58.6 dyne/cm; (12)Density: 1.84 g/cm3; (13)Flash Point: 134.1 °C; (14)Enthalpy of Vaporization: 53.81 kJ/mol; (15)Boiling Point: 298.2 °C at 760 mmHg; (16)Vapour Pressure: 0.00129 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=[N+]([O-])\C1=C(/C)C(/Br)=C\NC1=O
(2)InChI: InChI=1/C6H5BrN2O3/c1-3-4(7)2-8-6(10)5(3)9(11)12/h2H,1H3,(H,8,10)
(3)InChIKey: QXPNHVCGSASGIX-UHFFFAOYAL