Chemical Properties of Docosanoic acid, ethyl ester (CAS 5908-87-2)

Docosanoic acid, ethyl ester

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InChI
InChI=1S/C24H48O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-4-2/h3-23H2,1-2H3
InChI Key
JIZCYLOUIAIZHQ-UHFFFAOYSA-N
Formula
C24H48O2
SMILES
CCCCCCCCCCCCCCCCCCCCCC(=O)OCC
Molecular Weight1
368.64
CAS
5908-87-2
Other Names
  • Ethyl behenoate
  • Ethyl docosanoate
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Physical Properties

Property Value Unit Source
Δcsolid -15196.00 ± 1.00 kJ/mol NIST
Δf -82.72 kJ/mol Joback Calculated Property
Δfgas -783.49 kJ/mol Joback Calculated Property
Δfus 60.70 kJ/mol Joback Calculated Property
Δvap 78.17 kJ/mol Joback Calculated Property
log10WS -8.73 Crippen Calculated Property
logPoct/wat 8.371 Crippen Calculated Property
McVol 356.460 ml/mol McGowan Calculated Property
Pc 827.64 kPa Joback Calculated Property
Inp [2573.00; 2596.00]   Show Hide
Inp 2576.00 NIST
Inp 2596.00 NIST
Inp 2596.00 NIST
Inp 2593.50 NIST
Inp 2576.00 NIST
Inp 2573.00 NIST
Inp 2593.50 NIST
I [2883.00; 2883.00]   Show Hide
I 2883.00 NIST
I 2883.00 NIST
Tboil 824.81 K Joback Calculated Property
Tc 1009.81 K Joback Calculated Property
Tfus 432.40 K Joback Calculated Property
Vc 1.403 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1156.81; 1270.08] J/mol×K [824.81; 1009.81] Show Hide
Cp,gas 1156.81 J/mol×K 824.81 Joback Calculated Property
Cp,gas 1178.47 J/mol×K 855.64 Joback Calculated Property
Cp,gas 1198.97 J/mol×K 886.48 Joback Calculated Property
Cp,gas 1218.34 J/mol×K 917.31 Joback Calculated Property
Cp,gas 1236.63 J/mol×K 948.14 Joback Calculated Property
Cp,gas 1253.86 J/mol×K 978.97 Joback Calculated Property
Cp,gas 1270.08 J/mol×K 1009.81 Joback Calculated Property
η [0.0000418; 0.0010603] Pa×s [432.40; 824.81] Show Hide
η 0.0010603 Pa×s 432.40 Joback Calculated Property
η 0.0004342 Pa×s 497.80 Joback Calculated Property
η 0.0002188 Pa×s 563.20 Joback Calculated Property
η 0.0001271 Pa×s 628.61 Joback Calculated Property
η 0.0000818 Pa×s 694.01 Joback Calculated Property
η 0.0000568 Pa×s 759.41 Joback Calculated Property
η 0.0000418 Pa×s 824.81 Joback Calculated Property
ΔfusH [19.16; 77.82] kJ/mol [321.00; 321.00] Show Hide
ΔfusH 19.16 kJ/mol 321.00 NIST
ΔfusH 77.82 kJ/mol 321.00 NIST
ΔsubH 196.50 kJ/mol 315.50 NIST
ΔvapH 127.50 kJ/mol 335.50 NIST

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 514.20 K 1.30 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.61] kPa [596.00; 686.82] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A2.91277e+01
Coefficient B-1.24178e+04
Coefficient C-1.65424e+02
Temperature range, min.596.00
Temperature range, max.686.82
Pvap 1.33 kPa 596.00 Calculated Property
Pvap 2.58 kPa 606.09 Calculated Property
Pvap 4.85 kPa 616.18 Calculated Property
Pvap 8.87 kPa 626.27 Calculated Property
Pvap 15.79 kPa 636.36 Calculated Property
Pvap 27.46 kPa 646.46 Calculated Property
Pvap 46.68 kPa 656.55 Calculated Property
Pvap 77.66 kPa 666.64 Calculated Property
Pvap 126.63 kPa 676.73 Calculated Property
Pvap 202.61 kPa 686.82 Calculated Property

Similar Compounds

Ethyl henicosanoate. Ethyl tetracosanoate. Decanoic acid, ethyl ester. Heptadecanoic acid, ethyl ester. Nonadecanoic acid, ethyl ester. Nonanoic acid, ethyl ester. ethyl triacontanoate. ethyl tricosanoate. ethyl hentriacontanoate. Octadecanoic acid, ethyl ester. Octanoic acid, ethyl ester. Dodecanoic acid, ethyl ester. ethyl octanoate-d15. Hexadecanoic acid, ethyl ester. Tetradecanoic acid, ethyl ester.

Find more compounds similar to Docosanoic acid, ethyl ester.

Sources

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