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

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [332.71; 721.69] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A3.69730e+01
Coefficient B1.26084e+00
Coefficient C-6.78320e-04
Coefficient D1.02200e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 332.71 J/mol×K 273.00 Calculated Property
Cp,gas 402.66 J/mol×K 353.78 Calculated Property
Cp,gas 465.17 J/mol×K 434.56 Calculated Property
Cp,gas 520.57 J/mol×K 515.33 Calculated Property
Cp,gas 569.18 J/mol×K 596.11 Calculated Property
Cp,gas 611.33 J/mol×K 676.89 Calculated Property
Cp,gas 647.33 J/mol×K 757.67 Calculated Property
Cp,gas 677.50 J/mol×K 838.44 Calculated Property
Cp,gas 702.19 J/mol×K 919.22 Calculated Property
Cp,gas 721.69 J/mol×K 1000.00 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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