Database Results

Page 32 of 1850 compounds

METHYL ISOBUTYL ETHER Structure

METHYL ISOBUTYL ETHER

Acyclic ethers

CAS Number

625-44-5

SMILES String

CC(C)COC

Chemical Properties

Property Measured Predicted
Research Octane Number (-) - 99.44
Motor Octane Number (-) - 84.4
Cetane Number (-) - 53.22
Derived Cetane Number (-) - 39.63
Yield Sooting Index (-) - 31.89
Upper Flammability Limit (vol.%) - 11.02
Lower Flammability Limit (vol.%) 1.4 1.474
Lower Heating Value (kJ/mol) -3122 -3238

Physical Properties

Property Measured Predicted
Density (g/cm3@15~30°C) 0.7311 0.7399
Boiling Point (°C) 58.6 76.16
Melting Point (°C) - -106
Viscosity (mPa*s@20°C) - 0.5752
Enthalpy of Vaporization (kJ/mol@25°C) 30.13 30.08
Standard Enthalpy of Formation (kJ/mol@25°C) - -250.4
Vapor Pressure (kPa@25°C) 28.13 40.63
Surface Tension (dyne/cm@25°C) - 16.83
Flash Point (°C) -30 -23.56
Page 32 of 1850