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

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

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InChI
InChI=1S/C15H18O2/c1-4-9-14(5-2)17-15(16)12(3)13-10-7-6-8-11-13/h6-8,10-12,14H,5H2,1-3H3
InChI Key
UBDYWNRJPOSSMF-UHFFFAOYSA-N
Formula
C15H18O2
SMILES
CC#CC(CC)OC(=O)C(C)c1ccccc1
Molecular Weight1
230.30
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Physical Properties

Property Value Unit Source
Δf 151.83 kJ/mol Joback Calculated Property
Δfgas -99.46 kJ/mol Joback Calculated Property
Δfus 27.51 kJ/mol Joback Calculated Property
Δvap 61.79 kJ/mol Joback Calculated Property
log10WS -3.94 Crippen Calculated Property
logPoct/wat 3.135 Crippen Calculated Property
McVol 197.290 ml/mol McGowan Calculated Property
Pc 2256.81 kPa Joback Calculated Property
Inp 1620.00 NIST
Tboil 653.69 K Joback Calculated Property
Tc 881.56 K Joback Calculated Property
Tfus 433.49 K Joback Calculated Property
Vc 0.742 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [505.11; 591.21] J/mol×K [653.69; 881.56] Show Hide
Cp,gas 505.11 J/mol×K 653.69 Joback Calculated Property
Cp,gas 522.13 J/mol×K 691.67 Joback Calculated Property
Cp,gas 538.03 J/mol×K 729.65 Joback Calculated Property
Cp,gas 552.86 J/mol×K 767.63 Joback Calculated Property
Cp,gas 566.64 J/mol×K 805.61 Joback Calculated Property
Cp,gas 579.41 J/mol×K 843.59 Joback Calculated Property
Cp,gas 591.21 J/mol×K 881.56 Joback Calculated Property

Similar Compounds

Butyric acid, 2-phenyl-, hex-4-yn-3-yl ester. Hydratropic acid, 2-methyloct-5-yn-4-yl ester. Hydratropic acid, 2,7-dimethyloct-1-en-3-yn-5-yl ester. Butyric acid, 2-phenyl-, 2-methyloct-5-yn-4-yl ester. Hydratropic acid, tridec-2-yn-1-yl ester. Hydratropic acid, butyl ester. Butyric acid, 2-phenyl-, 2,7-dimethyloct-1-en-3-yn-5-yl ester. Butyric acid, 2-phenyl-, pent-2-yl ester. Butyric acid, 2-phenyl-, 2-methylpent-3-yl ester. Butyric acid, 2-phenyl-, but-3-yn-2-yl ester. Butyric acid, 2-phenyl-, hept-2-yl ester. Butyric acid, 2-phenyl-, 3-methylbut-2-yl ester. Butyric acid, 2-phenyl-, dec-2-yl ester. Butyric acid, 2-phenyl-, 4-methyl-2-pentyl ester. Hydratropic acid, pentyl ester.

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

Sources

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