Chemical Properties of Octanoic acid, tridec-2-ynyl ester

Octanoic acid, tridec-2-ynyl ester

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InChI
InChI=1S/C21H38O2/c1-3-5-7-9-10-11-12-13-14-16-18-20-23-21(22)19-17-15-8-6-4-2/h3-15,17,19-20H2,1-2H3
InChI Key
GHCSOROVZMLBDG-UHFFFAOYSA-N
Formula
C21H38O2
SMILES
CCCCCCCCCCC#CCOC(=O)CCCCCCC
Molecular Weight1
322.53
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Physical Properties

Property Value Unit Source
Δf 94.82 kJ/mol Joback Calculated Property
Δfgas -449.27 kJ/mol Joback Calculated Property
Δfus 56.05 kJ/mol Joback Calculated Property
Δvap 73.65 kJ/mol Joback Calculated Property
log10WS -7.27 Crippen Calculated Property
logPoct/wat 6.424 Crippen Calculated Property
McVol 305.590 ml/mol McGowan Calculated Property
Pc 1090.66 kPa Joback Calculated Property
Inp [2271.00; 2271.00]   Show Hide
Inp 2271.00 NIST
Inp 2271.00 NIST
Tboil 765.17 K Joback Calculated Property
Tc 946.83 K Joback Calculated Property
Tfus 504.69 K Joback Calculated Property
Vc 1.198 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [923.14; 1025.24] J/mol×K [765.17; 946.83] Show Hide
Cp,gas 923.14 J/mol×K 765.17 Joback Calculated Property
Cp,gas 942.50 J/mol×K 795.45 Joback Calculated Property
Cp,gas 960.89 J/mol×K 825.72 Joback Calculated Property
Cp,gas 978.33 J/mol×K 856.00 Joback Calculated Property
Cp,gas 994.85 J/mol×K 886.28 Joback Calculated Property
Cp,gas 1010.48 J/mol×K 916.55 Joback Calculated Property
Cp,gas 1025.24 J/mol×K 946.83 Joback Calculated Property

Similar Compounds

Hexanoic acid, tridec-2-ynyl ester. Undec-10-ynoic acid, tridec-2-yn-1-yl ester. Valeric acid, tridec-2-ynyl ester. Sebacic acid, ethyl tridec-2-ynyl ester. Glutaric acid, di(tridec-2-ynyl) ester. Sebacic acid, propyl tridec-2-ynyl ester. Butanoic acid, tridec-2-ynyl ester. Glutaric acid, ethyl tridec-2-ynyl ester. 6-Bromohexanoic acid, tridec-2-ynyl ester. Sebacic acid, butyl tridec-2-ynyl ester. 5-Bromovaleric acid, tridec-2-ynyl ester. Glutaric acid, propyl tridec-2-ynyl ester. Sebacic acid, isobutyl tridec-2-ynyl ester. Sebacic acid, pentyl tridec-2-ynyl ester. Glutaric acid, tridec-2-yn-1-yl neopentyl ester.

Find more compounds similar to Octanoic acid, tridec-2-ynyl ester.

Sources

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