Chemical Properties of Glutaric acid, but-3-yn-2-yl 2-isopropoxyphenyl ester

Glutaric acid, but-3-yn-2-yl 2-isopropoxyphenyl ester

InChI
InChI=1S/C18H22O5/c1-5-14(4)22-17(19)11-8-12-18(20)23-16-10-7-6-9-15(16)21-13(2)3/h1,6-7,9-10,13-14H,8,11-12H2,2-4H3
InChI Key
LIHDIPIUYUMPDC-UHFFFAOYSA-N
Formula
C18H22O5
SMILES
C#CC(C)OC(=O)CCCC(=O)Oc1ccccc1OC(C)C
Molecular Weight1
318.36
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Physical Properties

Property Value Unit Source
ΔfusH° 41.88 kJ/mol Joback Calculated Property
log10WS -3.26 Relay (1.0) Calculated Property
logPoct/wat 3.114 Crippen Calculated Property
McVol 252.870 ml/mol McGowan Calculated Property
Inp [2135.00; 2135.00]   Show Hide
Inp 2135.00 NIST
Inp 2135.00 NIST
Tfus 340.85 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 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 [726.17; 799.53] J/mol×K [771.20; 979.48] Show Hide
Cp,gas 726.17 J/mol×K 771.20 Joback Calculated Property
Cp,gas 741.34 J/mol×K 805.91 Joback Calculated Property
Cp,gas 755.31 J/mol×K 840.63 Joback Calculated Property
Cp,gas 768.11 J/mol×K 875.34 Joback Calculated Property
Cp,gas 779.74 J/mol×K 910.05 Joback Calculated Property
Cp,gas 790.20 J/mol×K 944.76 Joback Calculated Property
Cp,gas 799.53 J/mol×K 979.48 Joback Calculated Property

Similar Compounds

Glutaric acid, but-3-yn-2-yl 2-methoxyphenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2-isopropoxyphenyl ester. Glutaric acid, hex-4-yn-3-yl 2-isopropoxyphenyl ester. Glutaric acid, ethyl 2-isopropoxyphenyl ester. Glutaric acid, but-3-yn-2-yl 4-chloro-2-methoxyphenyl ester. Succinic acid, but-3-yn-2-yl 2-isopropoxyphenyl ester. Glutaric acid, but-3-yn-2-yl 2,6-dimethoxyphenyl ester. Glutaric acid, but-3-yn-2-yl 4-fluoro-2-methoxyphenyl ester. Glutaric acid, 2-isopropoxyphenyl propyl ester. Glutaric acid, butyl 2-isopropoxyphenyl ester. Glutaric acid, 2,2-dichloroethyl 2-isopropoxyphenyl ester. Glutaric acid, but-3-yn-2-yl 4-bromo-2-methoxyphenyl ester. Glutaric acid, 2-isopropoxyphenyl pentyl ester. Glutaric acid, 3-methylbut-2-yl 2-isopropoxyphenyl ester. Glutaric acid, hex-4-yn-3-yl 2-methoxyphenyl ester.

Find more compounds similar to Glutaric acid, but-3-yn-2-yl 2-isopropoxyphenyl ester.

Sources

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