The Piperazine,1-[(3-iodophenyl)methyl]-4-methyl-, with CAS registry number 859850-89-8, belongs to the following product category: Piperidines, Piperidones, Piperazines. It has the systematic name of 1-(3-iodobenzyl)-4-methylpiperazine. And the chemical formula of this chemical is C₁₂H₁₇IN₂.

Physical properties of Piperazine,1-[(3-iodophenyl)methyl]-4-methyl-: (1)ACD/LogP: 1.95; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 1.38; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 4.83; (6)ACD/KOC (pH 5.5): 1.48; (7)ACD/KOC (pH 7.4): 73.9; (8)#H bond acceptors: 2; (9)#H bond donors: 0; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: Å²; (12)Index of Refraction: 1.609; (13)Molar Refractivity: 72.36 cm³; (14)Molar Volume: 208.9 cm³; (15)Polarizability: 28.68×10^-24cm³; (16)Surface Tension: 44.9 dyne/cm; (17)Density: 1.513 g/cm³; (18)Flash Point: 162.2 °C; (19)Enthalpy of Vaporization: 58.85 kJ/mol; (20)Boiling Point: 344.6 °C at 760 mmHg; (21)Vapour Pressure: 6.53E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Ic2cc(CN1CCN(C)CC1)ccc2
(2)InChI: InChI=1/C12H17IN2/c1-14-5-7-15(8-6-14)10-11-3-2-4-12(13)9-11/h2-4,9H,5-8,10H2,1H3
(3)InChIKey: VQYQJWKSIRRHDZ-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C12H17IN2/c1-14-5-7-15(8-6-14)10-11-3-2-4-12(13)9-11/h2-4,9H,5-8,10H2,1H3
(5)Std. InChIKey: VQYQJWKSIRRHDZ-UHFFFAOYSA-N