Chemical Properties of Hexanoic acid, 3,5,5-trimethyl-, hex-4-yn-3-yl ester

Hexanoic acid, 3,5,5-trimethyl-, hex-4-yn-3-yl ester

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InChI
InChI=1S/C15H26O2/c1-7-9-13(8-2)17-14(16)10-12(3)11-15(4,5)6/h12-13H,8,10-11H2,1-6H3
InChI Key
PMXBDMXRFMGOQD-UHFFFAOYSA-N
Formula
C15H26O2
SMILES
CC#CC(CC)OC(=O)CC(C)CC(C)(C)C
Molecular Weight1
238.37
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Physical Properties

Property Value Unit Source
Δf 42.26 kJ/mol Joback Calculated Property
Δfgas -344.74 kJ/mol Joback Calculated Property
Δfus 26.05 kJ/mol Joback Calculated Property
Δvap 58.22 kJ/mol Joback Calculated Property
log10WS -4.39 Crippen Calculated Property
logPoct/wat 3.794 Crippen Calculated Property
McVol 221.050 ml/mol McGowan Calculated Property
Pc 1711.78 kPa Joback Calculated Property
Tboil 623.78 K Joback Calculated Property
Tc 823.14 K Joback Calculated Property
Tfus 409.49 K Joback Calculated Property
Vc 0.839 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [584.62; 681.25] J/mol×K [623.78; 823.14] Show Hide
Cp,gas 584.62 J/mol×K 623.78 Joback Calculated Property
Cp,gas 603.07 J/mol×K 657.01 Joback Calculated Property
Cp,gas 620.55 J/mol×K 690.23 Joback Calculated Property
Cp,gas 637.06 J/mol×K 723.46 Joback Calculated Property
Cp,gas 652.67 J/mol×K 756.69 Joback Calculated Property
Cp,gas 667.38 J/mol×K 789.91 Joback Calculated Property
Cp,gas 681.25 J/mol×K 823.14 Joback Calculated Property

Similar Compounds

Glutaric acid, 2-(adamant-1-yl)ethyl hex-4-yn-3-yl ester. Hexanoic acid, 3,5,5-trimethyl-, 2-methyloct-5-en-4-yl ester. 3-Cyclopentylpropionic acid, hex-4-yn-3-yl ester. Glutaric acid, cyclohexylmethyl hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl 2-ethylhexyl ester. Glutaric acid, hex-4-yn-3-yl 4-methylpent-2-yl ester. Glutaric acid, hex-4-yn-3-yl 2,4,4-trimethylpentyl ester. Glutaric acid, 2-norbornyl hex-4-yn-3-yl ester. Glutaric acid, 1-cyclopentylethyl hex-4-yn-3-yl ester. 3-Cyclopentylpropionic acid, 2-methyloct-5-yn-4-yl ester. Octanoic acid, hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl 3-methyl-5-methoxypentyl ester. Octanoic acid, 2-methyloct-5-yn-4-yl ester. Hexanoic acid, 3,5,5-trimethyl-, 2,7-dimethyloct-1-en-3-yn-5-yl ester. Hexanoic acid, 2-methyloct-5-yn-4-yl ester.

Find more compounds similar to Hexanoic acid, 3,5,5-trimethyl-, hex-4-yn-3-yl ester.

Sources

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