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

Dichloroacetic acid, hex-4-yn-3-yl ester

InChI
InChI=1S/C8H10Cl2O2/c1-3-5-6(4-2)12-8(11)7(9)10/h6-7H,4H2,1-2H3
InChI Key
HNJCYURZVMLJAK-UHFFFAOYSA-N
Formula
C8H10Cl2O2
SMILES
CC#CC(CC)OC(=O)C(Cl)Cl
Molecular Weight1
209.07
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Physical Properties

Property Value Unit Source
ΔfusH° 25.32 kJ/mol Joback Calculated Property
ΔvapH° 64.05 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 2.135 Crippen Calculated Property
McVol 146.900 ml/mol McGowan Calculated Property
Inp 1244.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, 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 [295.95; 353.96] J/mol×K [523.84; 739.64] Show Hide
Cp,gas 295.95 J/mol×K 523.84 Joback Calculated Property
Cp,gas 307.10 J/mol×K 559.81 Joback Calculated Property
Cp,gas 317.66 J/mol×K 595.77 Joback Calculated Property
Cp,gas 327.61 J/mol×K 631.74 Joback Calculated Property
Cp,gas 336.98 J/mol×K 667.71 Joback Calculated Property
Cp,gas 345.76 J/mol×K 703.67 Joback Calculated Property
Cp,gas 353.96 J/mol×K 739.64 Joback Calculated Property

Similar Compounds

Trichloroacetic acid, hex-4-yn-3-yl ester. 3-Chloropropionic acid, hex-4-yn-3-yl ester. Acetoxyacetic acid, hex-4-yn-3-yl ester. Butanoic acid, hex-4-yn-3-yl ester. 2,2-Dimethylpropanoic acid, hex-4-yn-3-yl ester. Glutaric acid, di(hex-4-yn-3-yl) ester. Glutaric acid, but-3-yn-2-yl hex-4-yn-3-yl ester. Cyclopropanecarboxylic acid, hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl isopropyl ester. valeric acid, hex-4-yn-3-yl ester. Glutaric acid, ethyl hex-4-yn-3-yl ester. 4-Bromobutanoic acid, hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl propyl ester. Dichloroacetic acid, 2-methyloct-5-yn-4-yl ester. Succinic acid, hex-4-yn-3-yl neopentyl ester.

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

Sources

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