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Name |
2-(3-Chlorophenyl)pyrrolidine |
EINECS | N/A |
CAS No. | 298690-74-1 | Density | 1.129 g/cm3 |
PSA | 12.03000 | LogP | 3.09330 |
Solubility | N/A | Melting Point |
N/A |
Formula | C10H12ClN | Boiling Point | 260.1 °C at 760 mmHg |
Molecular Weight | 181.665 | Flash Point | 111.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26 | Risk Codes | 36 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
2-(3-Chlorophenyl)pyrrolidine; |
Article Data | 5 |
The 3-(2-Chloro-phenyl)-pyrrolidine is an organic compound with the formula C10H12ClN. The systematic name of this chemical is 3-(2-chlorophenyl)pyrrolidine. With the CAS registry number 298690-74-1, it is also named as pyrrolidine, 3-(2-chlorophenyl)-. Besides, it is commonly used as pharmaceutical intermediates.
Physical properties about 3-(2-Chloro-phenyl)-pyrrolidine are: (1)ACD/LogP: 2.26; (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: 111.1 °C; (13)Enthalpy of Vaporization: 49.77 kJ/mol; (14)Boiling Point: 260.1 °C at 760 mmHg; (15)Vapour Pressure: 0.0125 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccccc1C2CCNC2
(2)InChI: InChI=1/C10H12ClN/c11-10-4-2-1-3-9(10)8-5-6-12-7-8/h1-4,8,12H,5-7H2
(3)InChIKey: RCQFNQQYVSNBOJ-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C10H12ClN/c11-10-4-2-1-3-9(10)8-5-6-12-7-8/h1-4,8,12H,5-7H2
(5)Std. InChIKey: RCQFNQQYVSNBOJ-UHFFFAOYSA-N