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55745-89-6

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Basic Information
CAS No.: 55745-89-6
Name: 1-(6-METHYLPYRID-2-YL)PIPERAZINE
Article Data: 6
Molecular Structure:
Molecular Structure of 55745-89-6 (1-(6-METHYLPYRID-2-YL)PIPERAZINE)
Formula: C10H15N3
Molecular Weight: 177.249
Synonyms: Piperazine,1-(6-methyl-2-pyridyl)- (6CI);1-(6-Methyl-2-pyridyl)piperazine;1-(6-Methylpyridin-2-yl)piperazine;
Density: 1.059g/cm3
Boiling Point: 335.1 °C at 760 mmHg
Flash Point: 156.5 °C
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36/37/39
PSA: 28.16000
LogP: 1.19340
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Specification

The Piperazine,1-(6-methyl-2-pyridinyl)-, with CAS registry number 55745-89-6, belongs to the following product categories: (1)Piperidine; (2)Pharmacetical. It has the systematic name of 1-(6-methylpyridin-2-yl)piperazine. Besides this, it is also called 1-[2-(6-Methylpyridyl)]-piperazine. And the chemical formula of this chemical is C10H15N3.

Physical properties of Piperazine,1-(6-methyl-2-pyridinyl)-: (1)ACD/LogP: 0.65; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.2; (4)ACD/LogD (pH 7.4): -0.67; (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): 2.54; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 19.37 Å2; (13)Index of Refraction: 1.543; (14)Molar Refractivity: 52.72 cm3; (15)Molar Volume: 167.2 cm3; (16)Polarizability: 20.9×10-24cm3; (17)Surface Tension: 40.8 dyne/cm; (18)Density: 1.059 g/cm3; (19)Flash Point: 156.5 °C; (20)Enthalpy of Vaporization: 57.81 kJ/mol; (21)Boiling Point: 335.1 °C at 760 mmHg; (22)Vapour Pressure: 0.000122 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Piperazine,1-(6-methyl-2-pyridinyl)- 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: n1c(cccc1N2CCNCC2)C
(2)InChI: InChI=1/C10H15N3/c1-9-3-2-4-10(12-9)13-7-5-11-6-8-13/h2-4,11H,5-8H2,1H3
(3)InChIKey: VOSMEFSBAHULFT-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C10H15N3/c1-9-3-2-4-10(12-9)13-7-5-11-6-8-13/h2-4,11H,5-8H2,1H3
(5)Std. InChIKey: VOSMEFSBAHULFT-UHFFFAOYSA-N