C1CCC=CC1 (cyclohexene)
Measured Cetane number: 18.1
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: 17.1
Similar Molecules
SMILES: CC1CCCC1
Cetane number (measured): 17.2
SMILES: CCC(C)C1=CC=CC=C1
Cetane number (measured): 6.0
SMILES: CCCC(C)C(=O)C
Cetane number (measured): 18.7
SMILES: C1COC=C1
Cetane number (measured): 20.0
SMILES: CC(C)C1=CC=CC=C1
Cetane number (measured): 15.0
SMILES: C1CCC(CC1)O
Cetane number (measured): 16.3
SMILES: CCCC(C)C(CC)O
Cetane number (measured): 16.0
SMILES: CCCCCC[C@](C)(CC)C1CCCC2CCCCC12
Cetane number (measured): 18.38
SMILES: CCC(C)(C)C(C)C
Cetane number (measured): 17.0
SMILES: CC[C@@H](C)C[C@@](C)(CC)c1ccc2ccccc2c1
Cetane number (measured): 17.5