Piperazine,1-[2-(2-pyridinyl)ethyl]- (53345-15-6)

The CAS register number of 1-[2-(2-Pyridinyl)ethyl]piperazine is 53345-15-6. It also can be called as Piperazine,1-[2-(2-pyridinyl)ethyl]- and the IUPAC name about this chemical is 1-(2-pyridin-2-ylethyl)piperazine. It belongs to the Piperidine.

Physical properties about 1-[2-(2-Pyridinyl)ethyl]piperazine are: (1)ACD/LogP: 0.28; (2)ACD/LogD (pH 5.5): -3.01; (3)ACD/LogD (pH 7.4): -1.48; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 19.37Ų; (12)Index of Refraction: 1.531; (13)Molar Refractivity: 57.26 cm³; (14)Molar Volume: 185 cm³; (15)Polarizability: 22.7x10^-24cm³; (16)Surface Tension: 39.7 dyne/cm; (17)Enthalpy of Vaporization: 54.66 kJ/mol; (18)Boiling Point: 306.1 °C at 760 mmHg; (19)Vapour Pressure: 0.000786 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of 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: n1c(cccc1)CCN2CCNCC2
(2)InChI: InChI=1/C11H17N3/c1-2-5-13-11(3-1)4-8-14-9-6-12-7-10-14/h1-3,5,12H,4,6-10H2
(3)InChIKey: NJUNCRDVGUBYCB-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C11H17N3/c1-2-5-13-11(3-1)4-8-14-9-6-12-7-10-14/h1-3,5,12H,4,6-10H2
(5)Std. InChIKey: NJUNCRDVGUBYCB-UHFFFAOYSA-N