Chemical Properties of 1,5-Pentanediol, O,O'-di(4-fluoro-2-trifluoromethylbenzoyl)-

1,5-Pentanediol, O,O'-di(4-fluoro-2-trifluoromethylbenzoyl)-

InChI
InChI=1S/C21H16F8O4/c22-12-4-6-14(16(10-12)20(24,25)26)18(30)32-8-2-1-3-9-33-19(31)15-7-5-13(23)11-17(15)21(27,28)29/h4-7,10-11H,1-3,8-9H2
InChI Key
RLMWRIIYAMUENS-UHFFFAOYSA-N
Formula
C21H16F8O4
SMILES
O=C(OCCCCCOC(=O)c1ccc(F)cc1C(F)(F)F)c1ccc(F)cc1C(F)(F)F
Molecular Weight1
484.34
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Physical Properties

Property Value Unit Source
ΔfusH° 55.22 kJ/mol Joback Calculated Property
log10WS -7.53 Relay (1.0) Calculated Property
logPoct/wat 6.187 Crippen Calculated Property
McVol 288.270 ml/mol McGowan Calculated Property
Pc 1153.78 kPa Joback Calculated Property
Inp [2346.00; 2346.00]   Show Hide
Inp 2346.00 NIST
Inp 2346.00 NIST
Tfus 347.13 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [886.62; 940.79] J/mol×K [857.50; 1053.67] Show Hide
Cp,gas 886.62 J/mol×K 857.50 Joback Calculated Property
Cp,gas 898.10 J/mol×K 890.19 Joback Calculated Property
Cp,gas 908.52 J/mol×K 922.89 Joback Calculated Property
Cp,gas 917.94 J/mol×K 955.58 Joback Calculated Property
Cp,gas 926.42 J/mol×K 988.28 Joback Calculated Property
Cp,gas 934.02 J/mol×K 1020.97 Joback Calculated Property
Cp,gas 940.79 J/mol×K 1053.67 Joback Calculated Property

Similar Compounds

4-Fluoro-2-trifluoromethylbenzoic acid, pentyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, hexyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, octyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, tridecyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, tetradecyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, undecyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, decyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, pentadecyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, heptyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, nonadecyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, eicosyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, dodecyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, nonyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, heptadecyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, octadecyl ester.

Find more compounds similar to 1,5-Pentanediol, O,O'-di(4-fluoro-2-trifluoromethylbenzoyl)-.

Sources

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