The 4-Pyridineethanamine,hydrochloride (1:1), with the CAS registry number 6429-12-5, is also known as 2-(Pyridin-4-yl)ethanamine hydrochloride (1:1). This chemical's molecular formula is C7H11ClN2 and molecular weight is 158.6286. Its systematic name is called 2-(pyridin-4-yl)ethanaminium chloride.
Physical properties of 4-Pyridineethanamine,hydrochloride (1:1): (1)ACD/LogD (pH 5.5): -3; (2)ACD/LogD (pH 7.4): -2; (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; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 3; (10)Flash Point: 113.9 °C; (11)Enthalpy of Vaporization: 46.73 kJ/mol; (12)Boiling Point: 230.7 °C at 760 mmHg; (13)Vapour Pressure: 0.065 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].[NH3+]CCc1ccncc1
(2)InChI: InChI=1/C7H10N2.ClH/c8-4-1-7-2-5-9-6-3-7;/h2-3,5-6H,1,4,8H2;1H
(3)InChIKey: GQGKWQYHIZXREV-UHFFFAOYAQ
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