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CAS No.: | 84487-08-1 |
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Name: | 2-AMINO-4-METHOXY-3-NITROPYRIDINE |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C6H7N3O3 |
Molecular Weight: | 169.13808 |
Synonyms: | 4-methoxy-3-nitropyridin-2-amine;2-pyridinamine, 4-methoxy-3-nitro-;4-methoxy-3-nitro-2-pyridylamine; |
Density: | 1.4 g/cm3 |
Melting Point: | 183-186°C |
Boiling Point: | 356.8 °C at 760 mmHg |
Flash Point: | 169.6 °C |
Appearance: | Yellow Crystalline Solid |
PSA: | 93.96000 |
LogP: | 1.68500 |
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The 2-Pyridinamine,4-methoxy-3-nitro-, with the CAS registry number 84487-08-1, has the systematic name of 4-methoxy-3-nitropyridin-2-amine. It is a kind of yellow crystalline solid, and belongs to the following product categories: Nucleotides and Nucleosides; Bases & Related Reagents; Nucleotides; Pyridines. And the molecular formula of the chemical is C6H7N3O3.
The characteristics of 2-Pyridinamine,4-methoxy-3-nitro- are as followings: (1)ACD/LogP: 1.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.74; (4)ACD/LogD (pH 7.4): 1.74; (5)ACD/BCF (pH 5.5): 12.33; (6)ACD/BCF (pH 7.4): 12.43; (7)ACD/KOC (pH 5.5): 209.75; (8)ACD/KOC (pH 7.4): 211.32; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 93.96 Å2; (13)Index of Refraction: 1.608; (14)Molar Refractivity: 41.8 cm3; (15)Molar Volume: 120.7 cm3; (16)Polarizability: 16.57×10-24cm3; (17)Surface Tension: 62.3 dyne/cm; (18)Density: 1.4 g/cm3; (19)Flash Point: 169.6 °C; (20)Enthalpy of Vaporization: 60.21 kJ/mol; (21)Boiling Point: 356.8 °C at 760 mmHg; (22)Vapour Pressure: 2.85E-05 mmHg at 25°C.
Preparation of 2-Pyridinamine,4-methoxy-3-nitro-: This chemical can be prepared by 4-chloro-3-nitro-pyridin-2-ylamine and methanol. The reaction will need reagent Na. The reaction time is 2 hours with heating, and the yield is about 56%.
Uses of 2-Pyridinamine,4-methoxy-3-nitro-: It can react be used to produce 2,3-diamino-4-methoxypyridine. This reaction will need reagent H2, catalyst 10% Pd/C, and the menstruum methanol. The reaction time is 1 hour with pressure of 760.0002Pa, and the yield is about 87%.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=[N+]([O-])c1c(ccnc1N)OC
(2)InChI: InChI=1/C6H7N3O3/c1-12-4-2-3-8-6(7)5(4)9(10)11/h2-3H,1H3,(H2,7,8)
(3)InChIKey: PHZNRPWDIPHQNO-UHFFFAOYAV