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

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

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InChI
InChI=1S/C15H18O2/c1-3-8-14(4-2)17-15(16)12-11-13-9-6-5-7-10-13/h5-7,9-10,14H,4,11-12H2,1-2H3
InChI Key
RLHCYVPRHPXILZ-UHFFFAOYSA-N
Formula
C15H18O2
SMILES
CC#CC(CC)OC(=O)CCc1ccccc1
Molecular Weight1
230.30
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Physical Properties

Property Value Unit Source
Δf 154.27 kJ/mol Joback Calculated Property
Δfgas -94.18 kJ/mol Joback Calculated Property
Δfus 31.03 kJ/mol Joback Calculated Property
Δvap 62.18 kJ/mol Joback Calculated Property
log10WS -3.97 Crippen Calculated Property
logPoct/wat 2.964 Crippen Calculated Property
McVol 197.290 ml/mol McGowan Calculated Property
Pc 2239.76 kPa Joback Calculated Property
Inp [1688.00; 1688.00]   Show Hide
Inp 1688.00 NIST
Inp 1688.00 NIST
Tboil 654.13 K Joback Calculated Property
Tc 877.48 K Joback Calculated Property
Tfus 448.49 K Joback Calculated Property
Vc 0.748 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [504.64; 589.28] J/mol×K [654.13; 877.48] Show Hide
Cp,gas 504.64 J/mol×K 654.13 Joback Calculated Property
Cp,gas 521.28 J/mol×K 691.36 Joback Calculated Property
Cp,gas 536.86 J/mol×K 728.58 Joback Calculated Property
Cp,gas 551.42 J/mol×K 765.81 Joback Calculated Property
Cp,gas 564.99 J/mol×K 803.03 Joback Calculated Property
Cp,gas 577.59 J/mol×K 840.26 Joback Calculated Property
Cp,gas 589.28 J/mol×K 877.48 Joback Calculated Property

Similar Compounds

3-Phenylpropionic acid, 2-methyloct-5-yn-4-yl ester. 3-Phenylpropionic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Butyric acid, 4-phenyl-, hex-4-yn-3-yl ester. 3-Phenylpropionic acid, 3-methylbut-2-yl ester. 3-Phenylpropionic acid, but-3-yn-2-yl ester. 3-Phenylpropionic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. Butyric acid, 4-phenyl-, 2-methyloct-5-yn-4-yl ester. 3-Phenylpropionic acid, tridec-2-ynyl ester. 3-Phenylpropionic acid, 2-methylbutyl ester. 3-Phenylpropionic acid, 2-methylpentyl ester. Benzenepropanoic acid, pentyl ester. 3-Phenylpropionic acid, 4-methoxy-2-methylbutyl ester. Benzenepropanoic acid, hexyl ester. Hydratropic acid, hex-4-yn-3-yl ester. Succinic acid, tridec-2-yn-1-yl 3-phenylpropyl ester.

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

Sources

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