Chemical Properties of Glutaric acid, 2-fluorophenyl cis-4-tert-butylcyclohexyl ester

Glutaric acid, 2-fluorophenyl cis-4-tert-butylcyclohexyl ester

InChI
InChI=1S/C21H29FO4/c1-21(2,3)15-11-13-16(14-12-15)25-19(23)9-6-10-20(24)26-18-8-5-4-7-17(18)22/h4-5,7-8,15-16H,6,9-14H2,1-3H3
InChI Key
QNOCRVOAUWZSEE-UHFFFAOYSA-N
Formula
C21H29FO4
SMILES
CC(C)(C)C1CCC(OC(=O)CCCC(=O)Oc2ccccc2F)CC1
Molecular Weight1
364.45
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Physical Properties

Property Value Unit Source
Δfus 41.11 kJ/mol Joback Calculated Property
logPoct/wat 5.050 Crippen Calculated Property
McVol 288.780 ml/mol McGowan Calculated Property
Inp [2506.00; 2506.00]   Show Hide
Inp 2506.00 NIST
Inp 2506.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [930.82; 1013.41] J/mol×K [839.10; 1053.94] Show Hide
Cp,gas 930.82 J/mol×K 839.10 Joback Calculated Property
Cp,gas 948.41 J/mol×K 874.91 Joback Calculated Property
Cp,gas 964.41 J/mol×K 910.71 Joback Calculated Property
Cp,gas 978.86 J/mol×K 946.52 Joback Calculated Property
Cp,gas 991.81 J/mol×K 982.33 Joback Calculated Property
Cp,gas 1003.31 J/mol×K 1018.13 Joback Calculated Property
Cp,gas 1013.41 J/mol×K 1053.94 Joback Calculated Property

Similar Compounds

Succinic acid, 2-fluorophenyl trans-4-tert-butylcyclohexyl ester. Glutaric acid, 2-fluorophenyl 2-methylhex-3-yl ester. Glutaric acid, 2-norbornyl 2-fluorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl cis-4-tert-butylcyclohexyl ester. Glutaric acid, 2-chloro-6-fluorophenyl trans-4-tert-butylcyclohexyl ester. Glutaric acid, 2-fluorophenyl 3-octyl ester. Succinic acid, 2-fluorophenyl trans-4-methylcyclohexyl ester. Succinic acid, 2-fluorophenyl cis-4-methylcyclohexyl ester. Glutaric acid, 2-fluorophenyl 2-heptyl ester. Glutaric acid, 2-fluorophenyl 2-octyl ester. Glutaric acid, 2-fluorophenyl hept-4-yl ester. Glutaric acid, 2-fluorophenyl 4-methylpent-2-yl ester. Glutaric acid, 2-fluorophenyl 2-hexyl ester. Glutaric acid, 2-fluorophenyl 3-hexyl ester. Glutaric acid, 3-chlorophenyl trans-4-tert-butylcyclohexyl ester.

Find more compounds similar to Glutaric acid, 2-fluorophenyl cis-4-tert-butylcyclohexyl ester.

Sources

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