Chemical Properties of Hydratropic acid, 2-methyloct-5-yn-4-yl ester

Hydratropic acid, 2-methyloct-5-yn-4-yl ester

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InChI
InChI=1S/C18H24O2/c1-5-6-12-17(13-14(2)3)20-18(19)15(4)16-10-8-7-9-11-16/h7-11,14-15,17H,5,13H2,1-4H3
InChI Key
HXVNSFXUARBLNQ-UHFFFAOYSA-N
Formula
C18H24O2
SMILES
CCC#CC(CC(C)C)OC(=O)C(C)c1ccccc1
Molecular Weight1
272.38
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Physical Properties

Property Value Unit Source
Δf 174.65 kJ/mol Joback Calculated Property
Δfgas -166.66 kJ/mol Joback Calculated Property
Δfus 31.76 kJ/mol Joback Calculated Property
Δvap 68.08 kJ/mol Joback Calculated Property
log10WS -4.95 Crippen Calculated Property
logPoct/wat 4.161 Crippen Calculated Property
McVol 239.560 ml/mol McGowan Calculated Property
Pc 1758.02 kPa Joback Calculated Property
Inp [1793.00; 1793.00]   Show Hide
Inp 1793.00 NIST
Inp 1793.00 NIST
Tboil 721.89 K Joback Calculated Property
Tc 942.19 K Joback Calculated Property
Tfus 452.30 K Joback Calculated Property
Vc 0.903 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [667.00; 759.53] J/mol×K [721.89; 942.19] Show Hide
Cp,gas 667.00 J/mol×K 721.89 Joback Calculated Property
Cp,gas 685.32 J/mol×K 758.61 Joback Calculated Property
Cp,gas 702.43 J/mol×K 795.32 Joback Calculated Property
Cp,gas 718.36 J/mol×K 832.04 Joback Calculated Property
Cp,gas 733.16 J/mol×K 868.76 Joback Calculated Property
Cp,gas 746.87 J/mol×K 905.48 Joback Calculated Property
Cp,gas 759.53 J/mol×K 942.19 Joback Calculated Property

Similar Compounds

Hydratropic acid, 2,7-dimethyloct-1-en-3-yn-5-yl ester. Butyric acid, 2-phenyl-, 2-methyloct-5-yn-4-yl ester. Butyric acid, 2-phenyl-, 2,7-dimethyloct-1-en-3-yn-5-yl ester. Hydratropic acid, hex-4-yn-3-yl ester. Butyric acid, 2-phenyl-, 4-methyl-2-pentyl ester. Phenylacetic acid, 2-methyloct-5-yn-4-yl ester. Butyric acid, 2-phenyl-, hex-4-yn-3-yl ester. Butyric acid, 2-phenyl-, 2-methylpent-3-yl ester. Benzeneacetic acid, 4-chloro-, 2-methyloct-5-yn-4-yl ester. Butyric acid, 2-phenyl-, pent-2-yl ester. Butyric acid, 2-phenyl-, hept-2-yl ester. Butyric acid, 2-phenyl-, dec-2-yl ester. Butyric acid, 2-phenyl-, 2-ethylhexyl ester. Phenylacetic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Di-(2-ethylbutyl)-2,5-diphenyl adipate.

Find more compounds similar to Hydratropic acid, 2-methyloct-5-yn-4-yl ester.

Sources

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