1-(3,5-Dimethoxyphenyl)piperazine

The Piperazine,1-(3,5-dimethoxyphenyl)-, with CAS registry number 53557-93-0, belongs to the following product category: Piperidines, Piperidones, Piperazines. It has the systematic name of 1-(3,5-dimethoxyphenyl)piperazine. Besides this, it is also called 4-(3,5-Dimethoxyphenyl)piperazine. And the chemical formula of this chemical is C₁₂H₁₈N₂O₂.

Physical properties of Piperazine,1-(3,5-dimethoxyphenyl)-: (1)ACD/LogP: 0.79; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.99; (4)ACD/LogD (pH 7.4): -0.39; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 4.19; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 24.94 Å²; (13)Index of Refraction: 1.526; (14)Molar Refractivity: 63.16 cm³; (15)Molar Volume: 205.7 cm³; (16)Polarizability: 25.03×10^-24cm³; (17)Surface Tension: 36.6 dyne/cm; (18)Density: 1.08 g/cm³; (19)Flash Point: 184.7 °C; (20)Enthalpy of Vaporization: 63 kJ/mol; (21)Boiling Point: 381.7 °C at 760 mmHg; (22)Vapour Pressure: 4.98E-06 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Piperazine,1-(3,5-dimethoxyphenyl)- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1cc(cc(OC)c1)N2CCNCC2)C
(2)InChI: InChI=1/C12H18N2O2/c1-15-11-7-10(8-12(9-11)16-2)14-5-3-13-4-6-14/h7-9,13H,3-6H2,1-2H3
(3)InChIKey: COWMQOCYJSUFSB-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C12H18N2O2/c1-15-11-7-10(8-12(9-11)16-2)14-5-3-13-4-6-14/h7-9,13H,3-6H2,1-2H3
(5)Std. InChIKey: COWMQOCYJSUFSB-UHFFFAOYSA-N