CCC(C)CC (3-methylpentane)
Measured Cetane number: 30.7
Measured using ASTM D6890 IQT. Reference: Abdul Jameel, A.G., Naser, N., Emwas, A.H., Dooley, S. and Sarathy, S.M., 2016. Predicting fuel ignition quality using 1H NMR spectroscopy and multiple linear regression. Energy & Fuels, 30(11), pp.9819-9835.
Estimated Cetane number: 31.7
Similar Molecules
SMILES: CCCCCCC(C)c1ccccc1
Cetane number (measured): 32.69
SMILES: CCCC(C)(C)C
Cetane number (measured): 30.0
SMILES: CCCCCCC1=CC=CC=C1
Cetane number (measured): 33.3
SMILES: CCCCCC=C
Cetane number (measured): 32.0
SMILES: CCC(CC)CC
Cetane number (measured): 34.1
SMILES: CCCCCC=CCC=CCCCCCCCC(=O)O
Cetane number (measured): 31.0
SMILES: CCCCC/C=C\C/C=C\CCCCCCCC(=O)O
Cetane number (measured): 31.4
SMILES: C=CCCCC
Cetane number (measured): 28.9
SMILES: CCCCC1CCCC2CCCCC12
Cetane number (measured): 30.815
SMILES: CC1CC(CC(C1)C)C
Cetane number (measured): 30.5