Chemical Properties of Undec-10-ynoic acid, but-3-yn-2-yl ester

Undec-10-ynoic acid, but-3-yn-2-yl ester

InChI
InChI=1S/C15H22O2/c1-4-6-7-8-9-10-11-12-13-15(16)17-14(3)5-2/h1-2,14H,6-13H2,3H3
InChI Key
WZSNKPVAHBCPQT-UHFFFAOYSA-N
Formula
C15H22O2
SMILES
C#CCCCCCCCCC(=O)OC(C)C#C
Molecular Weight1
234.34
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Physical Properties

Property Value Unit Source
ΔfusH° 41.40 kJ/mol Joback Calculated Property
logPoct/wat 3.305 Crippen Calculated Property
McVol 212.450 ml/mol McGowan Calculated Property
Inp [1642.00; 1642.00]   Show Hide
Inp 1642.00 NIST
Inp 1642.00 NIST
Tfus 304.63 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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 [527.98; 613.37] J/mol×K [580.82; 766.65] Show Hide
Cp,gas 527.98 J/mol×K 580.82 Joback Calculated Property
Cp,gas 544.15 J/mol×K 611.79 Joback Calculated Property
Cp,gas 559.52 J/mol×K 642.76 Joback Calculated Property
Cp,gas 574.10 J/mol×K 673.73 Joback Calculated Property
Cp,gas 587.91 J/mol×K 704.70 Joback Calculated Property
Cp,gas 600.99 J/mol×K 735.68 Joback Calculated Property
Cp,gas 613.37 J/mol×K 766.65 Joback Calculated Property

Similar Compounds

Sebacic acid, di(but-3-yn-2-yl) ester. Octanoic acid, but-3-yn-2-yl ester. Hexanoic acid, but-3-yn-2-yl ester. Valeric acid, but-3-yn-2-yl ester. Sebacic acid, but-3-yn-2-yl propyl ester. Glutaric acid, tridec-2-yn-1-yl but-3-yn-2-yl ester. 6-Bromohexanoic acid, but-3-yn-2-yl ester. Undec-10-ynoic acid, hex-4-yn-3-yl ester. Sebacic acid, butyl but-3-yn-2-yl ester. Sebacic acid, but-3-yn-2-yl isobutyl ester. Sebacic acid, but-3-yn-2-yl pentyl ester. Sebacic acid, but-3-yn-2-yl hexyl ester. Sebacic acid, but-3-yn-2-yl decyl ester. Sebacic acid, but-3-yn-2-yl nonyl ester. Sebacic acid, but-3-yn-2-yl octyl ester.

Find more compounds similar to Undec-10-ynoic acid, but-3-yn-2-yl ester.

Sources

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