Chemical Properties of Glutaric acid, hex-4-yn-3-yl 3-methyl-5-methoxypentyl ester

Glutaric acid, hex-4-yn-3-yl 3-methyl-5-methoxypentyl ester

InChI
InChI=1S/C18H30O5/c1-5-8-16(6-2)23-18(20)10-7-9-17(19)22-14-12-15(3)11-13-21-4/h15-16H,6-7,9-14H2,1-4H3
InChI Key
XMXVJZOWFJIWID-UHFFFAOYSA-N
Formula
C18H30O5
SMILES
CC#CC(CC)OC(=O)CCCC(=O)OCCC(C)CCOC
Molecular Weight1
326.43
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Physical Properties

Property Value Unit Source
ΔfusH° 45.21 kJ/mol Joback Calculated Property
logPoct/wat 3.108 Crippen Calculated Property
McVol 276.630 ml/mol McGowan Calculated Property
Inp [2158.00; 2158.00]   Show Hide
Inp 2158.00 NIST
Inp 2158.00 NIST
Tboil 599.55 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, 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 [832.87; 917.32] J/mol×K [794.36; 987.61] Show Hide
Cp,gas 832.87 J/mol×K 794.36 Joback Calculated Property
Cp,gas 849.56 J/mol×K 826.57 Joback Calculated Property
Cp,gas 865.20 J/mol×K 858.78 Joback Calculated Property
Cp,gas 879.80 J/mol×K 890.98 Joback Calculated Property
Cp,gas 893.35 J/mol×K 923.19 Joback Calculated Property
Cp,gas 905.86 J/mol×K 955.40 Joback Calculated Property
Cp,gas 917.32 J/mol×K 987.61 Joback Calculated Property

Similar Compounds

Glutaric acid, hex-4-yn-3-yl 3-methylbutyl ester. Glutaric acid, 2-methyloct-5-yn-4-yl pentyl ester. Glutaric acid, isohexyl 2-methyloct-5-yn-4-yl ester. Glutaric acid, 2-(adamant-1-yl)ethyl hex-4-yn-3-yl ester. Glutaric acid, butyl 2-methyloct-5-yn-4-yl ester. Glutaric acid, decyl 2-methyloct-5-yn-4-yl ester. Glutaric acid, 2-methyloct-5-yn-4-yl tridecyl ester. Glutaric acid, heptadecyl 2-methyloct-5-yn-4-yl ester. Glutaric acid, 2-methyloct-5-yn-4-yl octyl ester. Glutaric acid, 2-methyloct-5-yn-4-yl pentadecyl ester. Glutaric acid, hexadecyl 2-methyloct-5-yn-4-yl ester. Glutaric acid, 2-methyloct-5-yn-4-yl undecyl ester. Glutaric acid, dodecyl 2-methyloct-5-yn-4-yl ester. Glutaric acid, 2-methyloct-5-yn-4-yl nonyl ester. Glutaric acid, 2-methyloct-5-yn-4-yl tetradecyl ester.

Find more compounds similar to Glutaric acid, hex-4-yn-3-yl 3-methyl-5-methoxypentyl ester.

Sources

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