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79491-49-9

Basic Information
CAS No.: 79491-49-9
Name: 5,6-DiMethoxypyridin-3-aMine
Article Data: 6
Molecular Structure:
Molecular Structure of 79491-49-9 (5,6-DiMethoxypyridin-3-aMine)
Formula: C7H10N2O2
Molecular Weight: 154.169
Synonyms: 5,6-Dimethoxy-3-pyridinamine HCl;5,6-dimethoxy-3-pyridinamine;
Density: 1.159g/cm3
Melting Point: 91-92℃ (ligroine )
Boiling Point: 265.7 °C at 760 mmHg
Flash Point: 114.5 °C
PSA: 57.37000
LogP: 1.26220
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Specification

The 5,6-Dimethoxy-3-pyridinamine, with CAS registry number 79491-49-9, has the systematic name of 2,6-dimethoxypyridin-3-amine. Besides this, it is also called 3-pyridinamine, 2,6-dimethoxy-. And the chemical formula of this chemical is C7H10N2O2.

Physical properties of 5,6-Dimethoxy-3-pyridinamine: (1)ACD/LogP: 1.19; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.19; (4)ACD/LogD (pH 7.4): 1.19; (5)ACD/BCF (pH 5.5): 4.7; (6)ACD/BCF (pH 7.4): 4.72; (7)ACD/KOC (pH 5.5): 105.23; (8)ACD/KOC (pH 7.4): 105.76; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 34.59 Å2; (13)Index of Refraction: 1.543; (14)Molar Refractivity: 41.93 cm3; (15)Molar Volume: 132.9 cm3; (16)Polarizability: 16.62×10-24cm3; (17)Surface Tension: 43 dyne/cm; (18)Density: 1.159 g/cm3; (19)Flash Point: 114.5 °C; (20)Enthalpy of Vaporization: 50.36 kJ/mol; (21)Boiling Point: 265.7 °C at 760 mmHg; (22)Vapour Pressure: 0.00902 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1nc(OC)ccc1N)C
(2)InChI: InChI=1/C7H10N2O2/c1-10-6-4-3-5(8)7(9-6)11-2/h3-4H,8H2,1-2H3
(3)InChIKey: PTBHRJOTANEONS-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C7H10N2O2/c1-10-6-4-3-5(8)7(9-6)11-2/h3-4H,8H2,1-2H3
(5)Std. InChIKey: PTBHRJOTANEONS-UHFFFAOYSA-N