Chemical Properties of 2,2-Dimethylpropanoic acid, hex-4-yn-3-yl ester

2,2-Dimethylpropanoic acid, hex-4-yn-3-yl ester

InChI
InChI=1S/C11H18O2/c1-6-8-9(7-2)13-10(12)11(3,4)5/h9H,7H2,1-5H3
InChI Key
OHXKMFWHFLPFCX-UHFFFAOYSA-N
Formula
C11H18O2
SMILES
CC#CC(CC)OC(=O)C(C)(C)C
Molecular Weight1
182.26
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Physical Properties

Property Value Unit Source
ΔfusH° 20.80 kJ/mol Joback Calculated Property
ΔvapH° 61.19 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 2.378 Crippen Calculated Property
McVol 164.690 ml/mol McGowan Calculated Property
Tboil 449.35 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation 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 [378.41; 462.56] J/mol×K [514.83; 719.29] Show Hide
Cp,gas 378.41 J/mol×K 514.83 Joback Calculated Property
Cp,gas 394.53 J/mol×K 548.91 Joback Calculated Property
Cp,gas 409.78 J/mol×K 582.98 Joback Calculated Property
Cp,gas 424.18 J/mol×K 617.06 Joback Calculated Property
Cp,gas 437.76 J/mol×K 651.14 Joback Calculated Property
Cp,gas 450.55 J/mol×K 685.21 Joback Calculated Property
Cp,gas 462.56 J/mol×K 719.29 Joback Calculated Property

Similar Compounds

Succinic acid, hex-4-yn-3-yl neopentyl ester. Cyclopropanecarboxylic acid, hex-4-yn-3-yl ester. Butanoic acid, hex-4-yn-3-yl ester. Trichloroacetic acid, hex-4-yn-3-yl ester. Succinic acid, hex-4-yn-3-yl 3,3-dimethylbut-2-yl ester. 3-Chloropropionic acid, hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl neopentyl ester. Glutaric acid, di(hex-4-yn-3-yl) ester. Dichloroacetic acid, hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl isopropyl ester. 4-Bromobutanoic acid, hex-4-yn-3-yl ester. valeric acid, hex-4-yn-3-yl ester. Glutaric acid, but-3-yn-2-yl hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl isobutyl ester. Glutaric acid, ethyl hex-4-yn-3-yl ester.

Find more compounds similar to 2,2-Dimethylpropanoic acid, hex-4-yn-3-yl ester.

Sources

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