Database Results
Page 61 of 1850 compounds
3-methyl-1-butanol
AlcoholsCAS Number
123-51-3
SMILES String
CC(C)CCO
Chemical Properties
| Property | Measured | Predicted |
|---|---|---|
| Research Octane Number (-) | 98.8 | 97.1 |
| Motor Octane Number (-) | 84 | 79.25 |
| Cetane Number (-) | 13.1 | 15.94 |
| Derived Cetane Number (-) | 13.1 | 12.41 |
| Yield Sooting Index (-) | 31.9 | 34.82 |
| Upper Flammability Limit (vol.%) | 9 | 8.895 |
| Lower Flammability Limit (vol.%) | 1.2 | 1.275 |
| Lower Heating Value (kJ/mol) | -3062 | -3148 |
Physical Properties
| Property | Measured | Predicted |
|---|---|---|
| Density (g/cm3@15~30°C) | 0.8104 | 0.8111 |
| Boiling Point (°C) | 130.8 | 133 |
| Melting Point (°C) | -117.2 | -68.32 |
| Viscosity (mPa*s@20°C) | 5.11 | 16.39 |
| Enthalpy of Vaporization (kJ/mol@25°C) | 55.61 | 56.06 |
| Standard Enthalpy of Formation (kJ/mol@25°C) | - | -321.7 |
| Vapor Pressure (kPa@25°C) | 0.315 | 0.378 |
| Surface Tension (dyne/cm@25°C) | 24.77 | 23.92 |
| Flash Point (°C) | 43 | 40.35 |