The 2-Methoxy-4-pyridineethanamine with the CAS number 764708-27-2 is also called 4-Pyridineethanamine,2-methoxy-. Both the systematic name and IUPAC name are 2-(2-methoxypyridin-4-yl)ethanamine. Its molecular formula is C8H12N2O. The product category is Methyl.
The properties of the 2-Methoxy-4-pyridineethanamine are: (1)ACD/LogP: 0.83; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1.537; (7)#H bond acceptors: 3; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 48.14 Å2; (11)Index of Refraction: 1.528; (12)Molar Refractivity: 44.107 cm3; (13)Molar Volume: 143.154 cm3; (14)Polarizability: 17.485×10-24cm3; (15)Surface Tension: 41.674 dyne/cm; (16)Enthalpy of Vaporization: 49.316 kJ/mol; (17)Vapour Pressure: 0.016 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: COc1cc(ccn1)CCN
(2)InChI: InChI=1/C8H12N2O/c1-11-8-6-7(2-4-9)3-5-10-8/h3,5-6H,2,4,9H2,1H3
(3)InChIKey: DUGYYNICKFCEHC-UHFFFAOYAV
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