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CAS No.: | 676495-94-6 |
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Name: | Piperidine, 3-(4-fluorophenyl)- |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C11H14FN |
Molecular Weight: | 179.237 |
Synonyms: | 3-(4-Fluorophenyl)piperidine; |
Density: | 1.048 g/cm3 |
Boiling Point: | 261.8 °C at 760 mmHg |
Flash Point: | 112.1 °C |
PSA: | 12.03000 |
LogP: | 2.62150 |
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The 3-(4-Fluorophenyl)piperidine is also known as Piperidine,3-(4-fluorophenyl)-. And the CAS registry number of 3-(4-Fluorophenyl)piperidine is 676495-94-6. This chemical's molecular formula is C11H14FN and its molecular weight is 179.23. What's more, both its IUPAC name and systematic name are the same which is called 3-(4-Fluorophenyyl)piperidine.
Physical properties about 3-(4-Fluorophenyl)piperidine are: (1) ACD/LogP: 2.60; (2) # of Rule of 5 Violations: 0; (3) #H bond acceptors: 1; (4) #H bond donors: 1; (5) #Freely Rotating Bonds: 1; (6) Polar Surface Area: 12.03Å2; (7) Index of Refraction: 1.506; (8) Molar Refractivity: 50.84 cm3; (9) Molar Volume: 170.8 cm3; (10) Surface Tension: 34.2 dyne/cm; (11) Density: 1.048 g/cm3; (12) Flash Point: 112.1 °C; (13) Enthalpy of Vaporization: 49.96 kJ/mol; (14) Boiling Point: 261.8 °C at 760 mmHg; (15) Vapour Pressure: 0.0113 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: C1CC(CNC1)C2=CC=C(C=C2)F
(2) InChI: InChI=1S/C11H14FN/c12-11-5-3-9(4-6-11)10-2-1-7-13-8-10/h3-6,10,13H,1-2,7-8H2
(3) InChIKey: NKQDGXBXNNRWPR-UHFFFAOYSA-N