Chemical Properties of Sebacic acid, heptyl hex-4-yn-3-yl ester

Sebacic acid, heptyl hex-4-yn-3-yl ester

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InChI
InChI=1S/C23H40O4/c1-4-7-8-13-16-20-26-22(24)18-14-11-9-10-12-15-19-23(25)27-21(6-3)17-5-2/h21H,4,6-16,18-20H2,1-3H3
InChI Key
DRIWMITZMYMGAW-UHFFFAOYSA-N
Formula
C23H40O4
SMILES
CC#CC(CC)OC(=O)CCCCCCCCC(=O)OCCCCCCC
Molecular Weight1
380.56
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Physical Properties

Property Value Unit Source
Δf -124.70 kJ/mol Joback Calculated Property
Δfgas -740.63 kJ/mol Joback Calculated Property
Δfus 60.50 kJ/mol Joback Calculated Property
Δvap 86.87 kJ/mol Joback Calculated Property
log10WS -7.08 Crippen Calculated Property
logPoct/wat 5.966 Crippen Calculated Property
McVol 341.210 ml/mol McGowan Calculated Property
Pc 997.65 kPa Joback Calculated Property
Inp 2628.00 NIST
Tboil 886.78 K Joback Calculated Property
Tc 1086.62 K Joback Calculated Property
Tfus 584.39 K Joback Calculated Property
Vc 1.327 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1102.99; 1194.89] J/mol×K [886.78; 1086.62] Show Hide
Cp,gas 1102.99 J/mol×K 886.78 Joback Calculated Property
Cp,gas 1121.36 J/mol×K 920.09 Joback Calculated Property
Cp,gas 1138.48 J/mol×K 953.39 Joback Calculated Property
Cp,gas 1154.37 J/mol×K 986.70 Joback Calculated Property
Cp,gas 1169.05 J/mol×K 1020.00 Joback Calculated Property
Cp,gas 1182.55 J/mol×K 1053.31 Joback Calculated Property
Cp,gas 1194.89 J/mol×K 1086.62 Joback Calculated Property

Similar Compounds

Sebacic acid, hex-4-yn-3-yl undecyl ester. Sebacic acid, decyl hex-4-yn-3-yl ester. Sebacic acid, hex-4-yn-3-yl pentadecyl ester. Sebacic acid, hex-4-yn-3-yl octyl ester. Sebacic acid, hex-4-yn-3-yl nonyl ester. Sebacic acid, hex-4-yn-3-yl tetradecyl ester. Sebacic acid, hex-4-yn-3-yl tridecyl ester. Sebacic acid, hexyl hex-4-yn-3-yl ester. Sebacic acid, butyl hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl octyl ester. Glutaric acid, hex-4-yn-3-yl nonyl ester. Glutaric acid, dodecyl hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl tridecyl ester. Glutaric acid, heptadecyl hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl pentadecyl ester.

Find more compounds similar to Sebacic acid, heptyl hex-4-yn-3-yl ester.

Sources

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