Chemical Properties of Diglycolic acid, isohexyl oct-4-yl ester

Diglycolic acid, isohexyl oct-4-yl ester

InChI
InChI=1S/C18H34O5/c1-5-7-11-16(9-6-2)23-18(20)14-21-13-17(19)22-12-8-10-15(3)4/h15-16H,5-14H2,1-4H3
InChI Key
FXRLYVDCESVQQD-UHFFFAOYSA-N
Formula
C18H34O5
SMILES
CCCCC(CCC)OC(=O)COCC(=O)OCCCC(C)C
Molecular Weight1
330.46
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Physical Properties

Property Value Unit Source
ΔfusH° 45.26 kJ/mol Joback Calculated Property
logPoct/wat 3.885 Crippen Calculated Property
McVol 285.230 ml/mol McGowan Calculated Property
Inp [2533.00; 2533.00]   Show Hide
Inp 2533.00 NIST
Inp 2533.00 NIST
Tboil 606.29 K Relay (1.0) Calculated Property
Tc 770.16 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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 [865.55; 956.74] J/mol×K [749.42; 926.96] Show Hide
Cp,gas 865.55 J/mol×K 749.42 Joback Calculated Property
Cp,gas 883.29 J/mol×K 779.01 Joback Calculated Property
Cp,gas 900.01 J/mol×K 808.60 Joback Calculated Property
Cp,gas 915.71 J/mol×K 838.19 Joback Calculated Property
Cp,gas 930.39 J/mol×K 867.78 Joback Calculated Property
Cp,gas 944.07 J/mol×K 897.37 Joback Calculated Property
Cp,gas 956.74 J/mol×K 926.96 Joback Calculated Property
η [0.0000360; 0.0021549] Pa×s [369.51; 749.42] Show Hide
η 0.0021549 Pa×s 369.51 Joback Calculated Property
η 0.0006616 Pa×s 432.83 Joback Calculated Property
η 0.0002746 Pa×s 496.15 Joback Calculated Property
η 0.0001391 Pa×s 559.47 Joback Calculated Property
η 0.0000809 Pa×s 622.78 Joback Calculated Property
η 0.0000520 Pa×s 686.10 Joback Calculated Property
η 0.0000360 Pa×s 749.42 Joback Calculated Property

Similar Compounds

Diglycolic acid, isohexyl 2-octyl ester. Diglycolic acid, isohexyl 2-pentyl ester. Diglycolic acid, oct-4-yl pentyl ester. Diglycolic acid, hexyl oct-4-yl ester. Diglycolic acid, butyl oct-4-yl ester. Diglycolic acid, oct-4-yl tetradecyl ester. Diglycolic acid, nonyl oct-4-yl ester. Diglycolic acid, dodecyl oct-4-yl ester. Diglycolic acid, octyl oct-4-yl ester. Diglycolic acid, oct-4-yl tridecyl ester. Diglycolic acid, heptyl oct-4-yl ester. Diglycolic acid, decyl oct-4-yl ester. Diglycolic acid, oct-4-yl undecyl ester. Diglycolic acid, oct-4-yl pentadecyl ester. Diglycolic acid, oct-4-yl propyl ester.

Find more compounds similar to Diglycolic acid, isohexyl oct-4-yl ester.

Sources

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