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500587-48-4

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Basic Information
CAS No.: 500587-48-4
Name: 1-(PIPERIDIN-1-YL-SULFONYL)-PIPERAZINE
Article Data: 1
Molecular Structure:
Molecular Structure of 500587-48-4 (1-(PIPERIDIN-1-YL-SULFONYL)-PIPERAZINE)
Formula: C9H19N3O2S
Molecular Weight: 233.335
Synonyms: NSC 142486;1-(Piperidin-1-ylsulfonyl)piperazine;TIMTEC-BB SBB010191;1-(Piperidine-1-sulfonyl)-piperazine;
Density: 1.29 g/cm3
Melting Point: 61-64 °C
Boiling Point: 382.5 °C at 760 mmHg
Flash Point: 185.1 °C
Hazard Symbols: IrritantXi
PSA: 61.03000
LogP: 0.90770
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Specification

The CAS register number of Piperazine,1-(1-piperidinylsulfonyl)- is 500587-48-4. It also can be called as 1-(Piperidine-1-sulfonyl)-piperazine and the systematic name about this chemical is 1-(piperidin-1-ylsulfonyl)piperazine. The molecular formula about this chemical is C9H19N3O2S and the molecular weight is 233.33. This chemical is irritant. It may cause inflammation to the skin or other mucous membranes.

Physical properties about Piperazine,1-(1-piperidinylsulfonyl)- are: (1)ACD/LogP: -1.17; (2)#H bond acceptors: 5; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 2; (5)Polar Surface Area: 52.24 Å2; (6)Index of Refraction: 1.576; (7)Molar Refractivity: 59.86 cm3; (8)Molar Volume: 180.7 cm3; (9)Polarizability: 23.73x10-24cm3; (10)Surface Tension: 54.8 dyne/cm; (11)Density: 1.29 g/cm3; (12)Flash Point: 185.1 °C; (13)Enthalpy of Vaporization: 63.09 kJ/mol; (14)Boiling Point: 382.5 °C at 760 mmHg; (15)Vapour Pressure: 4.7E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(N1CCCCC1)N2CCNCC2
(2)InChI: InChI=1/C9H19N3O2S/c13-15(14,11-6-2-1-3-7-11)12-8-4-10-5-9-12/h10H,1-9H2
(3)InChIKey: DRAVEXQQEXRRDS-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C9H19N3O2S/c13-15(14,11-6-2-1-3-7-11)12-8-4-10-5-9-12/h10H,1-9H2
(5)Std. InChIKey: DRAVEXQQEXRRDS-UHFFFAOYSA-N