The 4-Pyridinemethanamine,2-chloro-N-methyl- is an organic compound with the formula C7H9ClN2. The systematic name of this chemical is 1-(2-chloropyridin-4-yl)-N-methylmethanamine. With the CAS registry number 748187-76-0, it is also named as N-[(2-Chloropyridin-4-yl)methyl]-N-methylamine.
Physical properties about 4-Pyridinemethanamine,2-chloro-N-methyl- are: (1)ACD/LogP: 0.70; (2)ACD/LogD (pH 5.5): -1.54; (3)ACD/LogD (pH 7.4): 0.16; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 16.45; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 16.13 Å2; (12)Index of Refraction: 1.534; (13)Molar Refractivity: 42.38 cm3; (14)Molar Volume: 136.2 cm3; (15)Polarizability: 16.8×10-24cm3; (16)Surface Tension: 39.6 dyne/cm; (17)Density: 1.149 g/cm3; (18)Flash Point: 98.1 °C; (19)Enthalpy of Vaporization: 47.55 kJ/mol; (20)Boiling Point: 238.6 °C at 760 mmHg; (21)Vapour Pressure: 0.042 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1nccc(c1)CNC
(2)InChI: InChI=1/C7H9ClN2/c1-9-5-6-2-3-10-7(8)4-6/h2-4,9H,5H2,1H3
(3)InChIKey: NIBLXLUVASMQFM-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C7H9ClN2/c1-9-5-6-2-3-10-7(8)4-6/h2-4,9H,5H2,1H3
(5)Std. InChIKey: NIBLXLUVASMQFM-UHFFFAOYSA-N
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