The (-)-4-Chlorobenzhydrylamine, with CAS registry number 163837-57-8, has the systematic name of 1-(4-chlorophenyl)-1-phenylmethanamine. Besides this, it is also called benzenemethanamine, 4-chloro-α-phenyl. And the chemical formula od this chemical is C13H12ClN.
Physical properties of (-)-4-Chlorobenzhydrylamine: (1)ACD/LogP: 3.39; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 3.24 Å2; (7)Index of Refraction: 1.607; (8)Molar Refractivity: 64 cm3; (9)Molar Volume: 185.2 cm3; (10)Polarizability: 25.37×10-24cm3; (11)Surface Tension: 45.8 dyne/cm; (12)Enthalpy of Vaporization: 58 kJ/mol; (13)Vapour Pressure: 0.000109 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(cc1)C(N)c2ccccc2
(2)InChI: InChI=1/C13H12ClN/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9,13H,15H2
(3)InChIKey: XAFODXGEQUOEKN-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C13H12ClN/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9,13H,15H2
(5)Std. InChIKey: XAFODXGEQUOEKN-UHFFFAOYSA-N
|