Chemical Properties of (E)-13-Docosenoic acid (CAS 506-33-2)

(E)-13-Docosenoic acid

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InChI
InChI=1S/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h9-10H,2-8,11-21H2,1H3,(H,23,24)/b10-9+
InChI Key
DPUOLQHDNGRHBS-MDZDMXLPSA-N
Formula
C22H42O2
SMILES
CCCCCCCCC=CCCCCCCCCCCCC(=O)O
Molecular Weight1
338.57
CAS
506-33-2
Other Names
  • (E)-docos-13-enoic acid
  • 13-Docosenoic acid, (E)-
  • Brassidic acid
  • trans-13-Docosenoic acid
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Physical Properties

Property Value Unit Source
Δcsolid -13699.00 ± 2.70 kJ/mol NIST
Δf -51.16 kJ/mol Joback Calculated Property
Δfgas -645.00 kJ/mol Joback Calculated Property
Δfus 58.62 kJ/mol Joback Calculated Property
Δvap 87.95 kJ/mol Joback Calculated Property
log10WS -7.98 Crippen Calculated Property
logPoct/wat 7.669 Crippen Calculated Property
McVol 323.980 ml/mol McGowan Calculated Property
Pc 1025.31 kPa Joback Calculated Property
Tboil 852.97 K Joback Calculated Property
Tc 1044.39 K Joback Calculated Property
Tfus 443.37 K Joback Calculated Property
Vc 1.272 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1052.00; 1152.00] J/mol×K [852.97; 1044.39] Show Hide
Cp,gas 1052.00 J/mol×K 852.97 Joback Calculated Property
Cp,gas 1070.89 J/mol×K 884.87 Joback Calculated Property
Cp,gas 1088.82 J/mol×K 916.78 Joback Calculated Property
Cp,gas 1105.83 J/mol×K 948.68 Joback Calculated Property
Cp,gas 1121.99 J/mol×K 980.59 Joback Calculated Property
Cp,gas 1137.36 J/mol×K 1012.49 Joback Calculated Property
Cp,gas 1152.00 J/mol×K 1044.39 Joback Calculated Property
η [0.0000101; 0.0010953] Pa×s [443.37; 852.97] Show Hide
η 0.0010953 Pa×s 443.37 Joback Calculated Property
η 0.0002981 Pa×s 511.64 Joback Calculated Property
η 0.0001102 Pa×s 579.90 Joback Calculated Property
η 0.0000503 Pa×s 648.17 Joback Calculated Property
η 0.0000266 Pa×s 716.44 Joback Calculated Property
η 0.0000157 Pa×s 784.70 Joback Calculated Property
η 0.0000101 Pa×s 852.97 Joback Calculated Property
ΔvapH 103.40 kJ/mol 569.00 NIST

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr [529.20; 555.20] K [1.30; 4.00] Show Hide
Tboilr 529.20 K 1.30 NIST
Tboilr 555.20 K 4.00 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.65] kPa [562.12; 748.59] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.66104e+01
Coefficient B-6.84544e+03
Coefficient C-1.42742e+02
Temperature range, min.562.12
Temperature range, max.748.59
Pvap 1.33 kPa 562.12 Calculated Property
Pvap 2.87 kPa 582.84 Calculated Property
Pvap 5.79 kPa 603.56 Calculated Property
Pvap 10.96 kPa 624.28 Calculated Property
Pvap 19.71 kPa 645.00 Calculated Property
Pvap 33.82 kPa 665.71 Calculated Property
Pvap 55.69 kPa 686.43 Calculated Property
Pvap 88.41 kPa 707.15 Calculated Property
Pvap 135.83 kPa 727.87 Calculated Property
Pvap 202.65 kPa 748.59 Calculated Property

Similar Compounds

(Z)-Icos-9-enoic acid. Hexadecenoic acid, Z-11-. Oleic Acid. cis-13-Octadecenoic acid. 11-Octadecenoic acid, (Z)-. trans-13-Octadecenoic acid. 9-Hexadecenoic acid. Erucic acid. Palmitoleic acid. cis-11-Eicosenoic acid. 9-Octadecenoic acid. Myristoleic acid. 9-Octadecenoic acid. cis-10-Heptadecenoic acid. 13-docosenoic acid.

Find more compounds similar to (E)-13-Docosenoic acid.

Sources

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