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CAS No.: | 6627-95-8 |
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Name: | Pyridine, 2-butoxy-5-nitro- (7CI,9CI) |
Molecular Structure: | |
Formula: | C9H12N2O3 |
Molecular Weight: | 196.206 |
Synonyms: | NSC60265; |
Density: | 1.167 g/cm3 |
Melting Point: | 148-150 °C |
Boiling Point: | 301.4 °C at 760 mmHg |
Flash Point: | 136.1 °C |
PSA: | 67.94000 |
LogP: | 2.69190 |
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The Pyridine,2-butoxy-5-nitro-, with the CAS registry number 6627-95-8, is also known as 2-Butoxy-5-nitro-pyridine. It belongs to the product category of Pyridine. This chemical's molecular formula is C9H12N2O3 and molecular weight is 196.20318. Its systematic name is called 2-butoxy-5-nitropyridine.
Physical properties of Pyridine,2-butoxy-5-nitro-: (1)ACD/LogP: 2.92; (2)#H bond acceptors: 5; (3)#Freely Rotating Bonds: 5; (4)Index of Refraction: 1.524; (5)Molar Refractivity: 51.46 cm3; (6)Molar Volume: 168 cm3; (7)Surface Tension: 44 dyne/cm; (8)Density: 1.167 g/cm3; (9)Flash Point: 136.1 °C; (10)Enthalpy of Vaporization: 51.98 kJ/mol; (11)Boiling Point: 301.4 °C at 760 mmHg; (12)Vapour Pressure: 0.00189 mmHg at 25°C.
Preparation of Pyridine,2-butoxy-5-nitro-: this chemical can be prepared by 2-chloro-5-nitro-pyridine and butan-1-ol. This reaction will need reagent sodium metal. The reaction time is 24 hours with reaction temperature of 70 °C. The yield is about 55%.
You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1cnc(OCCCC)cc1
(2)InChI: InChI=1/C9H12N2O3/c1-2-3-6-14-9-5-4-8(7-10-9)11(12)13/h4-5,7H,2-3,6H2,1H3
(3)InChIKey: GEMGCBQSLUFODV-UHFFFAOYAY