Chemical Properties of Dimethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl isohexyl ester

Dimethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl isohexyl ester

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InChI
InChI=1S/C14H22BrF3O4/c1-9(2)6-5-7-21-11(19)13(3,4)12(20)22-10(8-15)14(16,17)18/h9-10H,5-8H2,1-4H3
InChI Key
GCWSEMVYWQOVFC-UHFFFAOYSA-N
Formula
C14H22BrF3O4
SMILES
CC(C)CCCOC(=O)C(C)(C)C(=O)OC(CBr)C(F)(F)F
Molecular Weight1
391.22
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Physical Properties

Property Value Unit Source
Δf -970.15 kJ/mol Joback Calculated Property
Δfgas -1411.95 kJ/mol Joback Calculated Property
Δfus 30.24 kJ/mol Joback Calculated Property
Δvap 65.69 kJ/mol Joback Calculated Property
log10WS -4.13 Crippen Calculated Property
logPoct/wat 3.861 Crippen Calculated Property
McVol 245.810 ml/mol McGowan Calculated Property
Pc 1623.29 kPa Joback Calculated Property
Inp 1591.00 NIST
Tboil 728.93 K Joback Calculated Property
Tc 917.04 K Joback Calculated Property
Tfus 428.27 K Joback Calculated Property
Vc 0.950 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [696.55; 767.71] J/mol×K [728.93; 917.04] Show Hide
Cp,gas 696.55 J/mol×K 728.93 Joback Calculated Property
Cp,gas 710.46 J/mol×K 760.28 Joback Calculated Property
Cp,gas 723.49 J/mol×K 791.63 Joback Calculated Property
Cp,gas 735.69 J/mol×K 822.98 Joback Calculated Property
Cp,gas 747.10 J/mol×K 854.34 Joback Calculated Property
Cp,gas 757.76 J/mol×K 885.69 Joback Calculated Property
Cp,gas 767.71 J/mol×K 917.04 Joback Calculated Property

Similar Compounds

Dimethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl pentyl ester. Dimethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl hexyl ester. Dimethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl heptyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl pentyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl hexyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl tetradecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl undecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl decyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl octyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl pentadecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl dodecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl hexadecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl nonyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl octadecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl heptadecyl ester.

Find more compounds similar to Dimethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl isohexyl ester.

Sources

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