Chemical Properties of Diethylmalonic acid, 2-chloro-6-fluorophenyl isobutyl ester

Diethylmalonic acid, 2-chloro-6-fluorophenyl isobutyl ester

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InChI
InChI=1S/C17H22ClFO4/c1-5-17(6-2,15(20)22-10-11(3)4)16(21)23-14-12(18)8-7-9-13(14)19/h7-9,11H,5-6,10H2,1-4H3
InChI Key
CVSOITUDTHCMNK-UHFFFAOYSA-N
Formula
C17H22ClFO4
SMILES
CCC(CC)(C(=O)OCC(C)C)C(=O)Oc1c(F)cccc1Cl
Molecular Weight1
344.81
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Physical Properties

Property Value Unit Source
Δf -488.77 kJ/mol Joback Calculated Property
Δfgas -896.10 kJ/mol Joback Calculated Property
Δfus 34.96 kJ/mol Joback Calculated Property
Δvap 77.23 kJ/mol Joback Calculated Property
log10WS -4.95 Crippen Calculated Property
logPoct/wat 4.390 Crippen Calculated Property
McVol 255.520 ml/mol McGowan Calculated Property
Pc 1584.75 kPa Joback Calculated Property
Inp 2018.00 NIST
Tboil 810.61 K Joback Calculated Property
Tc 1019.61 K Joback Calculated Property
Tfus 495.06 K Joback Calculated Property
Vc 0.978 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [740.00; 809.17] J/mol×K [810.61; 1019.61] Show Hide
Cp,gas 740.00 J/mol×K 810.61 Joback Calculated Property
Cp,gas 754.05 J/mol×K 845.44 Joback Calculated Property
Cp,gas 767.05 J/mol×K 880.28 Joback Calculated Property
Cp,gas 779.03 J/mol×K 915.11 Joback Calculated Property
Cp,gas 790.02 J/mol×K 949.94 Joback Calculated Property
Cp,gas 800.06 J/mol×K 984.78 Joback Calculated Property
Cp,gas 809.17 J/mol×K 1019.61 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, 2-chloro-6-fluorophenyl propyl ester. Diethylmalonic acid, butyl 2-chloro-6-fluorophenyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl pentyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl hexadecyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl octyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl hepyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl decyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl pentadecyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl undecyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl tetradecyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl tridecyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl dodecyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl hexyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl ethyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl 2-methylhex-3-yl ester.

Find more compounds similar to Diethylmalonic acid, 2-chloro-6-fluorophenyl isobutyl ester.

Sources

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