Name: 1-(6-Chloro-pyridazino-3-yl)piperidine
SKU: 1722-11-8

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Basic Information

Molecular Structure:
CAS No.:	1722-11-8
Name:	1-(6-Chloro-pyridazino-3-yl)piperidine
Article Data:	5

Formula:	C₉H₁₂ClN₃
Molecular Weight:	197.667
Synonyms:	Pyridazine,3-chloro-6-piperidino- (7CI,8CI);3-Chloro-6-(piperidin-1-yl)pyridazine;3-Chloro-6-piperidinopyridazine;1-(6-Chloro-pyridazino-3-yl)piperidine;
EINECS:	200-001-2
Density:	1.234 g/cm³
Melting Point:	80～82℃
Boiling Point:	388.6 °C at 760 mmHg
Flash Point:	188.8 °C
Hazard Symbols:	Xi
PSA:	29.02000
LogP:	2.18530

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Specification

The CAS register number of 1-(6-Chloro-pyridazino-3-yl)piperidine is 1722-11-8. It also can be called as Pyridazine,3-chloro-6-(1-piperidinyl)- and the systematic name about this chemical is 3-chloro-6-piperidin-1-ylpyridazine. The molecular formula about this chemical is C₉H₁₂ClN₃and molecular weight is 197.66.

Physical properties about 1-(6-Chloro-pyridazino-3-yl)piperidine are: (1)ACD/LogP: 1.95; (2)ACD/LogD (pH 5.5): 1.85; (3)ACD/LogD (pH 7.4): 1.95; (4)ACD/BCF (pH 5.5): 14.36; (5)ACD/BCF (pH 7.4): 17.76; (6)ACD/KOC (pH 5.5): 220.37; (7)ACD/KOC (pH 7.4): 272.69; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 29.02Å²; (11)Index of Refraction: 1.564; (12)Molar Refractivity: 52.14 cm³; (13)Molar Volume: 160 cm³; (14)Polarizability: 20.67x10^-24cm³; (15)Surface Tension: 51.5 dyne/cm; (16)Enthalpy of Vaporization: 63.78 kJ/mol; (17)Boiling Point: 388.6 °C at 760 mmHg; (18)Vapour Pressure: 3.02E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1nnc(cc1)N2CCCCC2
(2)InChI: InChI=1/C9H12ClN3/c10-8-4-5-9(12-11-8)13-6-2-1-3-7-13/h4-5H,1-3,6-7H2
(3)InChIKey: LCZPIRFDMBEGAZ-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C9H12ClN3/c10-8-4-5-9(12-11-8)13-6-2-1-3-7-13/h4-5H,1-3,6-7H2
(5)Std. InChIKey: LCZPIRFDMBEGAZ-UHFFFAOYSA-N