Chemical Properties of Acetic acid, [3-hydroxy-4,4'-carbonylbis(phenyleneoxy)di-], didodecyl ester (CAS 116436-40-9)

Acetic acid, [3-hydroxy-4,4'-carbonylbis(phenyleneoxy)di-], didodecyl ester

InChI
InChI=1S/C41H62O8/c1-3-5-7-9-11-13-15-17-19-21-29-46-39(43)32-48-35-25-23-34(24-26-35)41(45)37-28-27-36(31-38(37)42)49-33-40(44)47-30-22-20-18-16-14-12-10-8-6-4-2/h23-28,31,42H,3-22,29-30,32-33H2,1-2H3
InChI Key
JIVKFMXHZGNYIX-UHFFFAOYSA-N
Formula
C41H62O8
SMILES
CCCCCCCCCCCCOC(=O)COc1ccc(C(=O)c2ccc(OCC(=O)OCCCCCCCCCCCC)cc2O)cc1
Molecular Weight1
682.93
CAS
116436-40-9
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Physical Properties

Property Value Unit Source
ΔfusH° 104.58 kJ/mol Joback Calculated Property
log10WS -9.70 Relay (1.0) Calculated Property
logPoct/wat 10.309 Crippen Calculated Property
McVol 575.090 ml/mol McGowan Calculated Property
Pc 553.11 kPa Joback Calculated Property
Tfus 367.25 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 [2184.16; 2327.84] J/mol×K [1532.71; 2172.05] Show Hide
Cp,gas 2184.16 J/mol×K 1532.71 Joback Calculated Property
Cp,gas 2204.84 J/mol×K 1639.27 Joback Calculated Property
Cp,gas 2223.29 J/mol×K 1745.82 Joback Calculated Property
Cp,gas 2242.17 J/mol×K 1852.38 Joback Calculated Property
Cp,gas 2264.12 J/mol×K 1958.94 Joback Calculated Property
Cp,gas 2291.80 J/mol×K 2065.50 Joback Calculated Property
Cp,gas 2327.84 J/mol×K 2172.05 Joback Calculated Property
η [1.5024004e-08; 0.0000003] Pa×s [980.14; 1532.71] Show Hide
η 0.0000003 Pa×s 980.14 Joback Calculated Property
η 0.0000001 Pa×s 1072.24 Joback Calculated Property
η 7.6343551e-08 Pa×s 1164.33 Joback Calculated Property
η 4.6501234e-08 Pa×s 1256.43 Joback Calculated Property
η 3.0308525e-08 Pa×s 1348.52 Joback Calculated Property
η 2.0865719e-08 Pa×s 1440.62 Joback Calculated Property
η 1.5024004e-08 Pa×s 1532.71 Joback Calculated Property

Similar Compounds

Acetic acid, 4-benzoyl-3-hydroxyphenoxy-, dodecyl ester. Benzophenone, 2-hydroxy-4,4'-bis(tetradecyloxy)-. Benzophenone, 4,4'-didecyloxy-2-hydroxy-. Benzophenone, 2-hydroxy-4-octadecyloxy-. Benzophenone, 4-dodecyloxy-2-hydroxy-. Benzophenone, 2-hydroxy-4-decycloxy-. Benzophenone, 4-hexadecyloxy-2-hydroxy-. Octabenzone. Cinchonidine. Cinchonine. Benzophenone, 5-chloro-4-dodecyloxy-2-hydroxy-4'-methoxy-. Quinidine. Quinine. Uridine, 2',5'-bis-O-acetyl, 3'-O-TBDMS. Uridine, 3'-O-TBDMS.

Find more compounds similar to Acetic acid, [3-hydroxy-4,4'-carbonylbis(phenyleneoxy)di-], didodecyl ester.

Sources

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