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161610-12-4

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Basic Information
CAS No.: 161610-12-4
Name: 2-fluoro-3-piperidin-4-ylpyridine
Article Data: 1
Molecular Structure:
Molecular Structure of 161610-12-4 (2-fluoro-3-piperidin-4-ylpyridine)
Formula: C10H13FN2
Molecular Weight: 180.225
Synonyms: 4-(2-Fluoro-3-pyridyl)piperidine;
Density: 1.098 g/cm3
Boiling Point: 270.2 °C at 760 mmHg
Flash Point: 117.2 °C
PSA: 24.92000
LogP: 2.01650
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Specification

The Pyridine, 2-fluoro-3-(4-piperidinyl)-, with the CAS registry number 161610-12-4, is also known as 4-(2-Fluoro-3-pyridyl)piperidine. This chemical's molecular formula is C10H13FN2 and molecular weight is 180.23. What's more, its systematic name is 2-Fluoro-3-(piperidin-4-yl)pyridine.

Physical properties about Pyridine, 2-fluoro-3-(4-piperidinyl)- are: (1)ACD/LogP: 1.01; (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: 2; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 24.92 Å2; (11)Index of Refraction: 1.508; (12)Molar Refractivity: 48.93 cm3; (13)Molar Volume: 164.1 cm3; (14)Polarizability: 19.39×10-24 cm3; (15)Surface Tension: 38 dyne/cm; (16)Density: 1.098 g/cm3; (17)Flash Point: 117.2 °C; (18)Enthalpy of Vaporization: 50.84 kJ/mol; (19)Boiling Point: 270.2 °C at 760 mmHg; (20)Vapour Pressure: 0.00692 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1ncccc1C2CCNCC2
(2) InChI: InChI=1/C10H13FN2/c11-10-9(2-1-5-13-10)8-3-6-12-7-4-8/h1-2,5,8,12H,3-4,6-7H2
(3) InChIKey: FVRBPDYSPMCVLV-UHFFFAOYAH