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CAS No.: | 129540-21-2 |
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Name: | 2-(2-Chlorophenyl)pyrrolidine |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C10H12ClN |
Molecular Weight: | 181.665 |
Synonyms: | alpha,alpha-Diphenyl-L-prolinol; (S)-(-)-alpha,alpha-Diphenyl-2-pyrrol |
Density: | 1.129 g/cm3 |
Boiling Point: | 254.1 °C at 760 mmHg |
Flash Point: | 107.5 °C |
Appearance: | white to beige crystals or crystalline powder |
Hazard Symbols: | Xi |
PSA: | 12.03000 |
LogP: | 3.09330 |
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The 2-(2-Chlorophenyl)pyrrolidine is an organic compound with the formula C10H12ClN. The IUPAC name of this chemical is 2-(2-chlorophenyl)pyrrolidine. With the CAS registry number 129540-21-2, it is also named as pyrrolidine, 2-(2-chlorophenyl)-.
Physical properties about 2-(2-Chlorophenyl)pyrrolidine are: (1)ACD/LogP: 2.38; (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: 1.548; (7)Molar Refractivity: 51.13 cm3; (8)Molar Volume: 160.8 cm3; (9)Polarizability: 20.27×10-24cm3; (10)Surface Tension: 39 dyne/cm; (11)Density: 1.129 g/cm3; (12)Flash Point: 107.5 °C; (13)Enthalpy of Vaporization: 49.15 kJ/mol; (14)Boiling Point: 254.1 °C at 760 mmHg; (15)Vapour Pressure: 0.0176 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccccc1C2NCCC2
(2)InChI: InChI=1/C10H12ClN/c11-9-5-2-1-4-8(9)10-6-3-7-12-10/h1-2,4-5,10,12H,3,6-7H2
(3)InChIKey: AFXDPDJNNABZGP-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C10H12ClN/c11-9-5-2-1-4-8(9)10-6-3-7-12-10/h1-2,4-5,10,12H,3,6-7H2
(5)Std. InChIKey: AFXDPDJNNABZGP-UHFFFAOYSA-N