Formula | C6D5CD3 |
Chemical shift [ppm] (Assignment) |
1H: 2.03, 6.98 (H-1), 7.00 (H-3), 7.09 (H-2); 13C: 20.4(7), 125.2, 128.0, 128.9, 137.5 |
Coupling constants [Hz] | 2J(H,D) = 2.2; 3J(H,D) = 1.2 (H-1), 1.1 (H-2,H-3); 1J(C,D) = 22.0 (CD3), 19.0 (C-4), 24.0 (C-2,C-3) |
Molecular weight [g/mol] | 100.19 |
Density (d 20°/4°) | 0.94 |
Desiccants |
0.4nm (4A) molecular sieves, CaCl2, Na |
Melting point [°C] | -84.5 |
Boiling point [°C] | 109 |
Inflammation temperature [°C] | 4 |
Refraction index (n 20°/D) | 1.4940 |
Dynamic viscosity (20°C) [mPa s] | 0.58 |
Magnetic susceptibility (20°C) | -0.6179 x 10^(-6) |
Dielectrical constant | 2.4 |
Dipole momentum [D] | 0.4 |
Polarity [kJ/mol] | 141.9 |
Donor strength [kJ/mol] | - |
stefano.chimichi@gmail.com |