Database Results

Page 20 of 1850 compounds

ANETHOLE Structure

ANETHOLE

Acyclic ethers

CAS Number

104-46-1

SMILES String

C/C=C/C1=CC=C(C=C1)OC

Chemical Properties

Property Measured Predicted
Research Octane Number (-) - 104.6
Motor Octane Number (-) - 90.36
Cetane Number (-) - 13.6
Derived Cetane Number (-) - 15.36
Yield Sooting Index (-) - 192.4
Upper Flammability Limit (vol.%) 7.2 7.054
Lower Flammability Limit (vol.%) 0.9 0.8879
Lower Heating Value (kJ/mol) -5280 -5273

Physical Properties

Property Measured Predicted
Density (g/cm3@15~30°C) - 1
Boiling Point (°C) - 222.8
Melting Point (°C) - -9.736
Viscosity (mPa*s@20°C) - 2.662
Enthalpy of Vaporization (kJ/mol@25°C) - 52.75
Standard Enthalpy of Formation (kJ/mol@25°C) - -168.9
Vapor Pressure (kPa@25°C) 0.0066 0.005983
Surface Tension (dyne/cm@25°C) - 35.88
Flash Point (°C) 89 81.37
Page 20 of 1850