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CAS No.: | 127356-38-1 |
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Name: | 4-PYRIDINAMINE, 2-METHOXY-5-NITRO- |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C6H7N3O3 |
Molecular Weight: | 169.139 |
Synonyms: | 2-Methoxy-5-nitropyridin-4-amine; |
Density: | 1.4 g/cm3 |
Melting Point: | 138-141 °C |
Boiling Point: | 383.2 °C at 760 mmHg |
Flash Point: | 185.5 °C |
PSA: | 93.96000 |
LogP: | 1.68500 |
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The 4-Pyridinamine, 2-methoxy-5-nitro-, with the CAS registry number of 127356-38-1, is also known as 4-Amino-2-methoxy-5-nitropyridine. This chemical's molecular formula is C6H7N3O3 and molecular weight is 169.139. What's more, its systematic name is called 2-Methoxy-5-nitro-pyridin-4-amine.
Physical properties about 4-Pyridinamine, 2-methoxy-5-nitro- are: (1)ACD/LogP: 2.01; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.01; (4)ACD/LogD (pH 7.4): 2.01; (5)#H bond acceptors: 6; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 93.96 Å2; (9)Index of Refraction: 1.608; (10)Molar Refractivity: 41.8 cm3; (11)Molar Volume: 120.7 cm3; (12)Surface Tension: 62.3 dyne/cm; (13)Density: 1.4 g/cm3; (14)Flash Point: 185.5 °C; (15)Enthalpy of Vaporization: 63.17 kJ/mol; (16)Boiling Point: 383.2 °C at 760 mmHg; (17)Vapour Pressure: 4.49E-06 mmHg at 25 °C.
Preparation: this chemical is prepared by reaction of 2-Chloro-5-nitro-[4]pyridylamine with Methanol. The reaction needs reagent Na. The reaction time is 2 hours. The yield is about 55 %.
Uses of 4-Pyridinamine, 2-methoxy-5-nitro-: it is used to produce other chemicals. For example, it is used to produce 3, 4-Diamino-6-methoxypyridine. This reaction needs reagent H2, catalyst 10 % Pd/C and solvent Methanol. The reaction time is 1 hour. The yield is about 85 %.
You can still convert the following datas into molecular structure:
(1) SMILES: Nc1cc(OC)ncc1[N+]([O-])=O
(2) InChI: InChI=1/C6H7N3O3/c1-12-6-2-4(7)5(3-8-6)9(10)11/h2-3H,1H3,(H2,7,8)
(3) InChIKey: YVXWVLIBEUMASB-UHFFFAOYAZ