CCCCCCCC(=O)C (nonan-2-one)
Measured Cetane number: 46.1
Measured using ASTM D6890 IQT. Reference: Dahmen, M. and Marquardt, W., 2015. A novel group contribution method for the prediction of the derived cetane number of oxygenated hydrocarbons. Energy & Fuels, 29(9), pp.5781-5801.
Estimated Cetane number: 45.3
Similar Molecules
SMILES: CCCCCCCCC(=O)OC
Cetane number (measured): 49.29
SMILES: CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC
Cetane number (measured): 43.81
SMILES: CCCCC/C=C/C/C=C/CCCCCCCC(=O)OC
Cetane number (measured): 43.0
SMILES: CCCCCC=CCC=CCCCCCCCC(=O)OC
Cetane number (measured): 43.8
SMILES: CCCCCCC=CCCCCCCCCO
Cetane number (measured): 46.0
SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)O
Cetane number (measured): 46.1
SMILES: CCCCCCCCC=CCCCCCCCC(=O)O
Cetane number (measured): 46.0
SMILES: CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCCCC
Cetane number (measured): 41.6
SMILES: CCCCCC=CCC=CCCCCCCCC(=O)OCCCC
Cetane number (measured): 54.0
SMILES: CCCCCCCCOC(C)=O
Cetane number (measured): 44.405