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128562-25-4

Basic Information
CAS No.: 128562-25-4
Name: 4-Pyrrolidin-2-ylpyridine
Article Data: 4
Molecular Structure:
Molecular Structure of 128562-25-4 (4-Pyrrolidin-2-ylpyridine)
Formula: C9H12N2
Molecular Weight: 148.208
Synonyms: 2-(Pyridin-4-yl)pyrrolidine;4-(2-Pyrrolidinyl)pyridine;
Density: 1.043 g/cm3
Boiling Point: 253.81 °C at 760 mmHg
Flash Point: 107.301 °C
Solubility: Slightly soluble in water.
Hazard Symbols: IrritantXi
Risk Codes: 25
Safety: 45
PSA: 24.92000
LogP: 1.83490
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  • Pyridine,4-(2-pyrrolidinyl)-

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    Pyridine,4-(2-pyrrolidinyl)-

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  • 4-Pyrrolidin-2-ylpyridine

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Specification

The 4-Pyrrolidin-2-ylpyridine is an organic compound with the formula C9H12N2. The systematic name of this chemical is 4-pyrrolidin-2-ylpyridine. With the CAS registry number 128562-25-4, it is also named as Pyridine, 4-(2-pyrrolidinyl)-. The product's categories are Pyridine; Benzenes.

Physical properties about 4-Pyrrolidin-2-ylpyridine are: (1)ACD/LogP: 0.29; (2)ACD/LogD (pH 5.5): -2.83; (3)ACD/LogD (pH 7.4): -1.96; (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: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 16.13 Å2; (12)Index of Refraction: 1.536; (13)Molar Refractivity: 44.33 cm3; (14)Molar Volume: 142.1 cm3; (15)Polarizability: 17.57×10-24cm3; (16)Surface Tension: 41.3 dyne/cm; (17)Density: 1.042 g/cm3; (18)Flash Point: 107.3 °C; (19)Enthalpy of Vaporization: 49.12 kJ/mol; (20)Boiling Point: 253.8 °C at 760 mmHg; (21)Vapour Pressure: 0.0179 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1ccc(cc1)C2NCCC2
(2)InChI: InChI=1/C9H12N2/c1-2-9(11-5-1)8-3-6-10-7-4-8/h3-4,6-7,9,11H,1-2,5H2
(3)InChIKey: GDGNPIOGJLCICG-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C9H12N2/c1-2-9(11-5-1)8-3-6-10-7-4-8/h3-4,6-7,9,11H,1-2,5H2
(5)Std. InChIKey: GDGNPIOGJLCICG-UHFFFAOYSA-N