Chemical Properties of Fumaric acid, 2-methylpentyl 2-chloro-6-fluorophenyl ester

Fumaric acid, 2-methylpentyl 2-chloro-6-fluorophenyl ester

InChI
InChI=1S/C16H18ClFO4/c1-3-5-11(2)10-21-14(19)8-9-15(20)22-16-12(17)6-4-7-13(16)18/h4,6-9,11H,3,5,10H2,1-2H3/b9-8+
InChI Key
RGXGITCCZOJNIL-CMDGGOBGSA-N
Formula
C16H18ClFO4
SMILES
CCCC(C)COC(=O)C=CC(=O)Oc1c(F)cccc1Cl
Molecular Weight1
328.76
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Physical Properties

Property Value Unit Source
ΔfusH° 43.15 kJ/mol Joback Calculated Property
logPoct/wat 3.920 Crippen Calculated Property
McVol 237.130 ml/mol McGowan Calculated Property
Inp [2124.00; 2124.00]   Show Hide
Inp 2124.00 NIST
Inp 2124.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [647.94; 713.52] J/mol×K [759.18; 963.58] Show Hide
Cp,gas 647.94 J/mol×K 759.18 Joback Calculated Property
Cp,gas 661.32 J/mol×K 793.25 Joback Calculated Property
Cp,gas 673.68 J/mol×K 827.31 Joback Calculated Property
Cp,gas 685.06 J/mol×K 861.38 Joback Calculated Property
Cp,gas 695.47 J/mol×K 895.45 Joback Calculated Property
Cp,gas 704.95 J/mol×K 929.52 Joback Calculated Property
Cp,gas 713.52 J/mol×K 963.58 Joback Calculated Property

Similar Compounds

Fumaric acid, 2-ethylhexyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 2-ethylbutyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 2,4,4-trimethylpentyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 2-methylpentyl 2-fluorophenyl ester. Fumaric acid, 2-methylpentyl 2,4,6-trichlorophenyl ester. Fumaric acid, 3-methylbutyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 2-methylpentyl 2,3-dichlorophenyl ester. Fumaric acid, 2,6-dichlorophenyl 2-ethylhexyl ester. Fumaric acid, 2-chlorophenyl 2-ethylhexyl ester. Fumaric acid, 2,4-dichlorophenyl 2-ethylhexyl ester. Fumaric acid, 2-ethylhexyl 2-fluorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 2-methylpentyl ester. Succinic acid, 2-chloro-6-fluorophenyl 2-methylpentyl ester. Fumaric acid, 2,4,4-trimethylpentyl 2-fluorophenyl ester. Fumaric acid, 2,5-dichlorophenyl 2-ethylhexyl ester.

Find more compounds similar to Fumaric acid, 2-methylpentyl 2-chloro-6-fluorophenyl ester.

Sources

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