Chemical Properties of Sebacic acid, isobutyl 4-trifluoromethoxybenzyl ester

Sebacic acid, isobutyl 4-trifluoromethoxybenzyl ester

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InChI
InChI=1S/C22H31F3O5/c1-17(2)15-28-20(26)9-7-5-3-4-6-8-10-21(27)29-16-18-11-13-19(14-12-18)30-22(23,24)25/h11-14,17H,3-10,15-16H2,1-2H3
InChI Key
LVVHCJCSPGHUQW-UHFFFAOYSA-N
Formula
C22H31F3O5
SMILES
CC(C)COC(=O)CCCCCCCCC(=O)OCc1ccc(OC(F)(F)F)cc1
Molecular Weight1
432.47
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Physical Properties

Property Value Unit Source
Δf -919.73 kJ/mol Joback Calculated Property
Δfgas -1496.53 kJ/mol Joback Calculated Property
Δfus 51.45 kJ/mol Joback Calculated Property
Δvap 84.09 kJ/mol Joback Calculated Property
log10WS -6.97 Crippen Calculated Property
logPoct/wat 5.948 Crippen Calculated Property
McVol 323.140 ml/mol McGowan Calculated Property
Pc 1077.10 kPa Joback Calculated Property
Inp [2389.00; 2389.00]   Show Hide
Inp 2389.00 NIST
Inp 2389.00 NIST
Tboil 903.56 K Joback Calculated Property
Tc 1106.81 K Joback Calculated Property
Tfus 532.38 K Joback Calculated Property
Vc 1.262 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1049.27; 1122.85] J/mol×K [903.56; 1106.81] Show Hide
Cp,gas 1049.27 J/mol×K 903.56 Joback Calculated Property
Cp,gas 1064.56 J/mol×K 937.44 Joback Calculated Property
Cp,gas 1078.59 J/mol×K 971.31 Joback Calculated Property
Cp,gas 1091.40 J/mol×K 1005.19 Joback Calculated Property
Cp,gas 1103.02 J/mol×K 1039.06 Joback Calculated Property
Cp,gas 1113.49 J/mol×K 1072.94 Joback Calculated Property
Cp,gas 1122.85 J/mol×K 1106.81 Joback Calculated Property

Similar Compounds

Glutaric acid, isobutyl 4-(trifluoromethoxy)benzyl ester. Sebacic acid, propyl 4-trifluoromethoxybenzyl ester. Sebacic acid, isobutyl 4-methoxybenzyl ester. Pimelic acid, isobutyl 4-methoxybenzyl ester. Sebacic acid, octyl 4-trifluoromethoxybenzyl ester. Sebacic acid, heptyl 4-trifluoromethoxybenzyl ester. Sebacic acid, pentyl 4-trifluoromethoxybenzyl ester. Sebacic acid, hexyl 4-trifluoromethoxybenzyl ester. Sebacic acid, 4-trifluoromethoxybenzyl undecyl ester. Sebacic acid, nonyl 4-trifluoromethoxybenzyl ester. Sebacic acid, decyl 4-trifluoromethoxybenzyl ester. Sebacic acid, butyl 4-trifluoromethoxybenzyl ester. Glutaric acid, hexadecyl 4-(trifluoromethoxy)benzyl ester. Glutaric acid, pentadecyl 4-(trifluoromethoxy)benzyl ester. Glutaric acid, 4-(trifluoromethoxy)benzyl tridecyl ester.

Find more compounds similar to Sebacic acid, isobutyl 4-trifluoromethoxybenzyl ester.

Sources

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