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CAS No.: | 72216-06-9 |
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Name: | 2-(4-Fluorophenyl)-pyrrolidine |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C10H12FN |
Molecular Weight: | 165.21 |
Synonyms: | 2-(4-Fluorophenyl)pyrrolidine; |
Density: | 1.078 g/cm3 |
Boiling Point: | 235.5 °C at 760 mmHg |
Flash Point: | 96.3 °C |
Hazard Symbols: | Xi |
PSA: | 12.03000 |
LogP: | 2.57900 |
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The 2-(4-Fluorophenyl)-pyrrolidine is an organic compound with the formula C10H12FN. The IUPAC name of this chemical is 2-(4-fluorophenyl)pyrrolidine. With the CAS registry number 72216-06-9, it is also named as rolidine, 2-(4-fluorophenyl)-. The product's categories are Pharmacetical; Pyrrole & Pyrrolidine & Pyrroline; Benzenes.
Physical properties about 2-(4-Fluorophenyl)-pyrrolidine are: (1)ACD/LogP: 1.83; (2)#H bond acceptors: 1; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 1; (5)Polar Surface Area: 3.24 Å2; (6)Index of Refraction: 1.515; (7)Molar Refractivity: 46.23 cm3; (8)Molar Volume: 153.1 cm3; (9)Polarizability: 18.32×10-24cm3; (10)Surface Tension: 35.3 dyne/cm; (11)Density: 1.078 g/cm3; (12)Flash Point: 96.3 °C; (13)Enthalpy of Vaporization: 47.23 kJ/mol; (14)Boiling Point: 235.5 °C at 760 mmHg; (15)Vapour Pressure: 0.0497 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccc(cc1)C2NCCC2
(2)InChI: InChI=1/C10H12FN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6,10,12H,1-2,7H2
(3)InChIKey: ZDCXMSDSTZZWAX-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C10H12FN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6,10,12H,1-2,7H2
(5)Std. InChIKey: ZDCXMSDSTZZWAX-UHFFFAOYSA-N