Ethanamine,2-(4-chlorophenoxy)-N-methyl- (65686-13-7)

The [2-(4-Chlorophenoxy)ethyl](methyl)amine with the CAS number 65686-13-7 is also called Ethanamine,2-(4-chlorophenoxy)-N-methyl-. Both the systematic name and IUPAC name are 2-(4-chlorophenoxy)-N-methylethanamine. Its molecular formula is C₉H₁₂ClNO. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the [2-(4-Chlorophenoxy)ethyl](methyl)amine are: (1)ACD/LogP: 2.17; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 12.47 Å²; (7)Index of Refraction: 1.518; (8)Molar Refractivity: 50.68 cm³; (9)Molar Volume: 167.2 cm³; (10)Polarizability: 20.09×10^-24cm³; (11)Surface Tension: 35.2 dyne/cm; (12)Enthalpy of Vaporization: 51.16 kJ/mol; (13)Vapour Pressure: 0.00579 mmHg at 25°C.

Uses: This chemical can react with 2-chlorosulfonylmethyl-3-methyl-butyric acid tert-butyl ester to prepare 2-({[2-(4-chloro-phenoxy)-ethyl]-methyl-sulfamoyl}-methyl)-3-methyl-butyric acid tert-butyl ester. This reaction needs reagent Et₃N and solvent CH₂Cl₂. The yield is 95%.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(OCCNC)cc1
(2)InChI: InChI=1/C9H12ClNO/c1-11-6-7-12-9-4-2-8(10)3-5-9/h2-5,11H,6-7H2,1H3
(3)InChIKey: RGLUIFRWIKUDEI-UHFFFAOYAC