N-(2,6-Dichlorobenzyl)ethanolamine (40172-05-2)

The cas register number of N-(2,6-Dichlorobenzyl)ethanolamine is 40172-05-2. The Systematic name about this chemical is 2-[(2,6-dichlorobenzyl)amino]ethanol.

Physical properties about N-(2,6-Dichlorobenzyl)ethanolamine are: (1)ACD/LogP: 2.32; (2)ACD/LogD (pH 5.5): 0.38; (3)ACD/LogD (pH 7.4): 1.99; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 15.85; (6)ACD/KOC (pH 5.5): 5.02; (7)ACD/KOC (pH 7.4): 202.02; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 12.47 Å²; (12)Index of Refraction: 1.568; (13)Molar Refractivity: 55.35 cm³; (14)Molar Volume: 168.9 cm³; (15)Polarizability: 21.94x10^-24cm³; (16)Surface Tension: 46 dyne/cm; (17)Enthalpy of Vaporization: 62.42 kJ/mol; (18)Vapour Pressure: 2.06E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cccc(Cl)c1CNCCO
(2)InChI: InChI=1/C9H11Cl2NO/c10-8-2-1-3-9(11)7(8)6-12-4-5-13/h1-3,12-13H,4-6H2
(3)InChIKey: WHOLKBDVEGPXOL-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C9H11Cl2NO/c10-8-2-1-3-9(11)7(8)6-12-4-5-13/h1-3,12-13H,4-6H2
(5)Std. InChIKey: WHOLKBDVEGPXOL-UHFFFAOYSA-N