Chemical Properties of Hexanoic acid, 3,5,5-trimethyl-, tridec-2-yn-1-yl ester

Hexanoic acid, 3,5,5-trimethyl-, tridec-2-yn-1-yl ester

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InChI Key
Molecular Weight1

Physical Properties

Property Value Unit Source
Δf 103.64 kJ/mol Joback Calculated Property
Δfgas -483.94 kJ/mol Joback Calculated Property
Δfus 47.71 kJ/mol Joback Calculated Property
Δvap 74.19 kJ/mol Joback Calculated Property
logPoct/wat 6.53 Crippen Calculated Property
Pc 1042.60 kPa Joback Calculated Property
Tboil 784.38 K Joback Calculated Property
Tc 973.01 K Joback Calculated Property
Tfus 503.38 K Joback Calculated Property
Vc 1.24 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 985.40 J/mol×K 784.38 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
-CH3 5
#C- 2
-CH2- 12
>C< 1
>C=O (nonring) 1

Similar Compounds

Hexanoic acid, tridec-2-ynyl ester. Undec-10-ynoic acid, tridec-2-yn-1-yl ester. Sebacic acid, ethyl tridec-2-ynyl ester. Octanoic acid, tridec-2-ynyl ester. Glutaric acid, tridec-2-yn-1-yl 3,7-dimethyloctyl ester. Sebacic acid, propyl tridec-2-ynyl ester. 3-Cyclopentylpropionic acid, tridec-2-ynyl ester. Glutaric acid, 2-(cyclohexyl)ethyl tridec-2-yn-1-yl ester. Sebacic acid, isobutyl tridec-2-ynyl ester. Sebacic acid, butyl tridec-2-ynyl ester. Sebacic acid, isohexyl tridec-2-ynyl ester. Sebacic acid, octyl tridec-2-ynyl ester. Sebacic acid, pentyl tridec-2-ynyl ester. Sebacic acid, hexyl tridec-2-ynyl ester. Sebacic acid, heptyl tridec-2-ynyl ester.

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