C/C(=C\C1=CC=CC=C1)/C=O ((E)-2-methyl-3-phenylprop-2-enal)
Measured Cetane number: 19.1
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: 18.8
Similar Molecules
SMILES: CC(=CC1=CC=CC=C1)C=O
Cetane number (measured): 19.1
SMILES: CC(=CCC/C(=C/CO)/C)C
Cetane number (measured): 16.5
SMILES: CC(=CCCC(=CCO)C)C
Cetane number (measured): 19.3
SMILES: CC(=CCCC(=CCCC(C)(C=C)O)C)C
Cetane number (measured): 19.2
SMILES: CC(=CCC/C(=C/CCC(C)(C=C)O)/C)C
Cetane number (measured): 19.2
SMILES: CCCC1=CC(=C(C=C1)O)OC
Cetane number (measured): 18.0
SMILES: CCC1=CC(=C(C=C1)O)OC
Cetane number (measured): 19.6
SMILES: COC1=CC=CC=C1O
Cetane number (measured): 19.3
SMILES: C1CCC(=O)CC1
Cetane number (measured): 10.4
SMILES: CC(C)(OC)OC
Cetane number (measured): 31.3