Phenacetin

Compound Structure

CAS Number: 62-44-2

Molecular Mass: 179.22 g/mol

Formula: C10H13NO2

Smiles: CCOc1ccc(NC(C)=O)cc1

Synonymes:

Bioactivity: -

Solubility in Different Solvents

Solvent Temperature [K] Crystal form Solubility [mg/mL] Reference
1-Butanol 283.15 - 23.5 [336]
1-Butanol 283.37 - 33.01 [337]
1-Butanol 288.15 - 27.54 [336]
1-Butanol 288.15 - 39.43 [337]
1-Butanol 293.15 - 32.58 [336]
1-Butanol 293.73 - 48.66 [337]
1-Butanol 298.15 - 39.44 [336]
1-Butanol 298.2 - 57.98 [337]
1-Butanol 303.15 - 47.7 [336]
1-Butanol 303.18 - 71.02 [337]
1-Butanol 308.05 - 87.15 [337]
1-Butanol 308.15 - 57.0 [336]
1-Butanol 313.15 - 69.85 [336]
1-Butanol 313.23 - 108.8 [337]
1-Butanol 318.15 - 85.84 [336]
1-Butanol 318.43 - 136.2 [337]
1-Butanol 323.15 - 109.8 [336]
1-Butanol 323.25 - 167.6 [337]
1-Butanol 328.15 - 206.6 [337]
1-Butanol 333.27 - 256.6 [337]
1-Pentanol 282.95 - 19.3 [337]
1-Pentanol 288.23 - 22.99 [337]
1-Pentanol 293.27 - 27.58 [337]
1-Pentanol 298.2 - 33.41 [337]
1-Pentanol 303.15 - 40.92 [337]
1-Pentanol 307.95 - 50.09 [337]
1-Pentanol 312.95 - 61.99 [337]
1-Pentanol 317.87 - 76.41 [337]
1-Pentanol 323.17 - 95.45 [337]
1-Pentanol 328.3 - 117.9 [337]
1-Pentanol 333.27 - 144.0 [337]
1-Propanol 282.65 - 21.88 [337]
1-Propanol 283.15 - 26.07 [336]
1-Propanol 288.15 - 31.82 [336]
1-Propanol 289.25 - 30.14 [337]
1-Propanol 293.15 - 38.38 [336]
1-Propanol 293.45 - 35.89 [337]
1-Propanol 298.15 - 46.94 [336]
1-Propanol 298.25 - 43.63 [337]
1-Propanol 303.15 - 57.9 [336]
1-Propanol 303.31 - 53.91 [337]
1-Propanol 307.85 - 65.68 [337]
1-Propanol 308.15 - 73.22 [336]
1-Propanol 313.15 - 92.38 [336]
1-Propanol 313.3 - 83.94 [337]
1-Propanol 318.15 - 111.4 [336]
1-Propanol 318.15 - 104.9 [337]
1-Propanol 323.15 - 140.5 [336]
1-Propanol 323.25 - 132.8 [337]
1-Propanol 328.45 - 168.6 [337]
1-Propanol 333.7 - 213.9 [337]
2-Butanol 283.15 - 17.92 [336]
2-Butanol 288.15 - 22.12 [336]
2-Butanol 293.15 - 26.65 [336]
2-Butanol 298.15 - 32.48 [336]
2-Butanol 303.15 - 39.58 [336]
2-Butanol 308.15 - 48.8 [336]
2-Butanol 313.15 - 59.57 [336]
2-Butanol 318.15 - 74.44 [336]
2-Butanol 323.15 - 95.88 [336]
Acetonitrile 283.15 - 19.41 [336]
Acetonitrile 288.15 - 23.24 [336]
Acetonitrile 293.15 - 28.88 [336]
Acetonitrile 298.15 - 38.65 [336]
Acetonitrile 303.15 - 50.16 [336]
Acetonitrile 308.15 - 63.73 [336]
Acetonitrile 313.15 - 80.56 [336]
Acetonitrile 318.15 - 101.5 [336]
Acetonitrile 323.15 - 125.7 [336]
Benzene 283.1 - 1.61 [337]
Benzene 288.15 - 2.536 [337]
Benzene 293.1 - 3.242 [337]
Benzene 297.9 - 3.925 [337]
Benzene 303.25 - 4.9 [337]
Benzene 308.23 - 6.213 [337]
Benzene 313.15 - 8.081 [337]
Benzene 318.15 - 10.75 [337]
Benzene 322.85 - 14.13 [337]
Benzene 328.35 - 19.38 [337]
Benzene 333.15 - 25.33 [337]
Dimethylacetamide 283.15 - 327.5 [336]
Dimethylacetamide 288.15 - 379.7 [336]
Dimethylacetamide 293.15 - 440.4 [336]
Dimethylacetamide 298.15 - 518.3 [336]
Dimethylacetamide 303.15 - 611.4 [336]
Dimethylacetamide 308.15 - 709.6 [336]
Dimethylacetamide 313.15 - 821.3 [336]
Dimethylacetamide 318.15 - 963.3 [336]
Dimethylacetamide 323.15 - 1131.0 [336]
Dimethylformamide 283.15 - 226.5 [336]
Dimethylformamide 288.15 - 251.2 [336]
Dimethylformamide 293.15 - 275.9 [336]
Dimethylformamide 298.15 - 307.2 [336]
Dimethylformamide 303.15 - 346.5 [336]
Dimethylformamide 308.15 - 389.5 [336]
Dimethylformamide 313.15 - 445.7 [336]
Dimethylformamide 318.15 - 514.0 [336]
Dimethylformamide 323.15 - 611.7 [336]
Ethanol 282.65 - 30.25 [337]
Ethanol 283.15 - 31.74 [336]
Ethanol 288.15 - 39.13 [336]
Ethanol 289.25 - 40.19 [337]
Ethanol 293.15 - 48.82 [336]
Ethanol 293.41 - 47.3 [337]
Ethanol 298.15 - 60.59 [336]
Ethanol 298.25 - 57.17 [337]
Ethanol 303.15 - 77.73 [336]
Ethanol 303.31 - 70.16 [337]
Ethanol 307.85 - 84.88 [337]
Ethanol 308.15 - 95.46 [336]
Ethanol 313.15 - 120.8 [336]
Ethanol 313.3 - 107.4 [337]
Ethanol 318.15 - 153.7 [336]
Ethanol 318.25 - 133.5 [337]
Ethanol 323.15 - 192.0 [336]
Ethanol 323.25 - 166.4 [337]
Ethanol 328.65 - 210.7 [337]
Ethanol 333.7 - 262.9 [337]
Ethyl acetate 282.65 - 11.09 [337]
Ethyl acetate 283.15 - 11.7 [336]
Ethyl acetate 288.15 - 15.23 [336]
Ethyl acetate 289.45 - 15.35 [337]
Ethyl acetate 293.15 - 18.4 [336]
Ethyl acetate 293.3 - 17.72 [337]
Ethyl acetate 298.15 - 22.68 [336]
Ethyl acetate 298.35 - 21.15 [337]
Ethyl acetate 303.15 - 27.15 [336]
Ethyl acetate 303.17 - 25.06 [337]
Ethyl acetate 308.03 - 29.99 [337]
Ethyl acetate 308.15 - 34.18 [336]
Ethyl acetate 313.05 - 36.47 [337]
Ethyl acetate 313.15 - 42.21 [336]
Ethyl acetate 318.15 - 51.3 [336]
Ethyl acetate 318.25 - 45.06 [337]
Ethyl acetate 323.15 - 61.85 [336]
Ethyl acetate 323.25 - 55.53 [337]
Ethyl acetate 328.15 - 68.25 [337]
Ethyl acetate 333.15 - 84.29 [337]
Ethyl formate 283.15 - 13.9 [336]
Ethyl formate 288.15 - 16.17 [336]
Ethyl formate 293.15 - 19.57 [336]
Ethyl formate 298.15 - 23.48 [336]
Ethyl formate 303.15 - 27.53 [336]
Ethyl formate 308.15 - 33.76 [336]
Ethyl formate 313.15 - 41.63 [336]
Ethyl formate 318.15 - 50.63 [336]
Ethyl formate 323.15 - 65.89 [336]
Isopropanol 283.15 - 21.39 [336]
Isopropanol 288.15 - 22.57 [336]
Isopropanol 293.15 - 27.17 [336]
Isopropanol 298.15 - 35.63 [336]
Isopropanol 303.15 - 47.06 [336]
Isopropanol 308.15 - 58.96 [336]
Isopropanol 313.15 - 74.71 [336]
Isopropanol 318.15 - 95.87 [336]
Isopropanol 323.15 - 121.2 [336]
Methanol 283.15 - 49.04 [336]
Methanol 283.74 - 47.3 [337]
Methanol 288.15 - 60.12 [336]
Methanol 288.15 - 57.66 [337]
Methanol 293.15 - 73.63 [336]
Methanol 293.83 - 74.49 [337]
Methanol 298.15 - 91.66 [336]
Methanol 298.18 - 90.94 [337]
Methanol 303.15 - 119.3 [336]
Methanol 303.18 - 114.7 [337]
Methanol 308.05 - 144.0 [337]
Methanol 308.15 - 153.6 [336]
Methanol 313.15 - 196.0 [336]
Methanol 313.25 - 183.2 [337]
Methanol 318.1 - 228.6 [337]
Methanol 318.15 - 253.2 [336]
Methanol 323.15 - 347.0 [336]
Methanol 323.25 - 287.6 [337]
Methanol 328.15 - 355.9 [337]
Methanol 333.45 - 445.8 [337]
Propyl acetate 283.15 - 9.355 [336]
Propyl acetate 288.15 - 11.1 [336]
Propyl acetate 293.15 - 13.03 [336]
Propyl acetate 298.15 - 15.24 [336]
Propyl acetate 303.15 - 18.98 [336]
Propyl acetate 308.15 - 22.22 [336]
Propyl acetate 313.15 - 26.94 [336]
Propyl acetate 318.15 - 33.09 [336]
Propyl acetate 323.15 - 42.76 [336]
Tetrahydrofuran 283.03 - 42.88 [337]
Tetrahydrofuran 288.35 - 52.42 [337]
Tetrahydrofuran 293.88 - 62.53 [337]
Tetrahydrofuran 298.17 - 74.67 [337]
Tetrahydrofuran 303.15 - 89.7 [337]
Tetrahydrofuran 307.95 - 107.5 [337]
Tetrahydrofuran 313.15 - 131.4 [337]
Tetrahydrofuran 318.15 - 159.7 [337]
Tetrahydrofuran 323.45 - 196.8 [337]
Tetrahydrofuran 328.33 - 238.6 [337]
Tetrahydrofuran 333.55 - 293.1 [337]

Molecule 3D descriptors

Descriptor Value
PMI1 177.2914
PMI2 1647.7223
PMI3 1815.3750
NPR1 0.0977
NPR2 0.9076
RadiusOfGyration 3.1869
InertialShapeFactor 0.0051
Eccentricity 0.9952
Asphericity 0.7355
SpherocityIndex 0.0385
PBF 0.2193