Molecular Structure of 2-(4-Bromobenzyl)pyrrolidine (CAS No.383127-68-2):
Molecular Formula: C11H14BrN
Molecular Weight: 240.1396
CAS No: 383127-68-2
H bond acceptors: 1
H bond donors: 1
Freely Rotating Bonds: 2
Polar Surface Area: 3.24 Å2
Index of Refraction: 1.568
Molar Refractivity: 58.65 cm3
Molar Volume: 179.2 cm3
Surface Tension: 41.3 dyne/cm
Density: 1.339 g/cm3
Flash Point: 139.2 °C
Enthalpy of Vaporization: 54.71 kJ/mol
Boiling Point: 306.6 °C at 760 mmHg
Vapour Pressure: 0.000765 mmHg at 25°C
InChI: InChI=1/C11H14BrN/c12-10-5-3-9(4-6-10)8-11-2-1-7-13-11/h3-6,11,13H,1-2,7-8H2
InChIKey: PRNKZLSWJHKYQX-UHFFFAOYAV
Std. InChI: InChI=1S/C11H14BrN/c12-10-5-3-9(4-6-10)8-11-2-1-7-13-11/h3-6,11,13H,1-2,7-8H2
Std. InChIKey: PRNKZLSWJHKYQX-UHFFFAOYSA-N
2-(4-Bromobenzyl)pyrrolidine (CAS No.383127-68-2), its synonym is 2-[(4-Bromophenyl)methyl]pyrrolidine .
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