Chemical Properties of Pentafluorobenzoic acid, 4-methoxy-2-methylbutyl ester

Pentafluorobenzoic acid, 4-methoxy-2-methylbutyl ester

InChI
InChI=1S/C13H13F5O3/c1-6(3-4-20-2)5-21-13(19)7-8(14)10(16)12(18)11(17)9(7)15/h6H,3-5H2,1-2H3
InChI Key
TZATVKGFHODXTB-UHFFFAOYSA-N
Formula
C13H13F5O3
SMILES
COCCC(C)COC(=O)c1c(F)c(F)c(F)c(F)c1F
Molecular Weight1
312.23
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Physical Properties

Property Value Unit Source
ΔfusH° 37.37 kJ/mol Joback Calculated Property
IE 9.47 eV Relay (1.0) Calculated Property
logPoct/wat 3.212 Crippen Calculated Property
McVol 192.430 ml/mol McGowan Calculated Property
Inp 1509.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [507.84; 571.94] J/mol×K [643.04; 815.54] Show Hide
Cp,gas 507.84 J/mol×K 643.04 Joback Calculated Property
Cp,gas 519.86 J/mol×K 671.79 Joback Calculated Property
Cp,gas 531.35 J/mol×K 700.54 Joback Calculated Property
Cp,gas 542.32 J/mol×K 729.29 Joback Calculated Property
Cp,gas 552.74 J/mol×K 758.04 Joback Calculated Property
Cp,gas 562.62 J/mol×K 786.79 Joback Calculated Property
Cp,gas 571.94 J/mol×K 815.54 Joback Calculated Property

Similar Compounds

Pentafluorobenzoic acid, 3-methylbutyl ester. Pentafluorobenzoic acid, 2-methylpentyl ester. 2,4-Difluorobenzoic acid, 4-methoxy-2-methylbutyl ester. Pentafluorobenzoic acid, butyl ester. 3-Fluorobenzoic acid, 4-methoxy-2-methylbutyl ester. 4-Methylpentan-2-yl 2,3,4,5,6-pentafluorobenzoate. 3-Chloro-2-fluorobenzoic acid, 4-methoxy-2-methylbutyl ester. 3,7-Dimethyloct-6-enyl 2,3,4,5,6-pentafluorobenzoate. 4-Fluorobenzoic acid, 4-methoxy-2-methylbutyl ester. 3-Methylbutan-2-yl 2,3,4,5,6-pentafluorobenzoate. pentyl pentafluorobenzoate. Hexyl 2,3,4,5,6-pentafluorobenzoate. 4-Chlorobenzoic acid, 4-methoxy-2-methylbutyl ester. Undecyl 2,3,4,5,6-pentafluorobenzoate. Decyl 2,3,4,5,6-pentafluorobenzoate.

Find more compounds similar to Pentafluorobenzoic acid, 4-methoxy-2-methylbutyl ester.

Sources

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