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CAS No.: | 142013-66-9 |
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Name: | 4-Piperazine-piperidine |
Molecular Structure: | |
Formula: | C9H19N3 |
Molecular Weight: | 169.27 |
Synonyms: | 4-Piperidinopiperazine; |
Density: | 0.997 g/cm3 |
Boiling Point: | 275.283 °C at 760 mmHg |
Flash Point: | 135.185 °C |
Appearance: | Gray power |
PSA: | 27.30000 |
LogP: | 0.23910 |
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This chemical is called Piperazine, 1-(4-piperidinyl)-, and its systematic name is 1-(piperidin-4-yl)piperazinato. With the molecular formula of C9H19N3, its molecular weight is 169.27. The CAS registry number of this chemical is 142013-66-9. Additionally, its product category is Piperidine.
Other characteristics of the Piperazine, 1-(4-piperidinyl)- can be summarised as followings: (1)ACD/LogP: -0.83; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 27.3 Å2; (11)Index of Refraction: 1.499; (12)Molar Refractivity: 49.812 cm3; (13)Molar Volume: 169.687 cm3; (14)Polarizability: 19.747×10-24cm3; (15)Surface Tension: 34.832 dyne/cm; (16)Density: 0.998 g/cm3; (17)Flash Point: 135.185 °C; (18)Enthalpy of Vaporization: 51.373 kJ/mol; (19)Boiling Point: 275.283 °C at 760 mmHg; (20)Vapour Pressure: 0.005 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: C1CC(CCN1)N2CCNCC2
2.InChI: InChI=1/C9H19N3/c1-3-10-4-2-9(1)12-7-5-11-6-8-12/h9-11H,1-8H2
3.InChIKey: ZHYYBDZASCMDMP-UHFFFAOYAY