Chemical Properties of Benzoic acid, 4-(propylthio)-, propyl ester

Benzoic acid, 4-(propylthio)-, propyl ester

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InChI
InChI=1S/C13H18O2S/c1-3-9-15-13(14)11-5-7-12(8-6-11)16-10-4-2/h5-8H,3-4,9-10H2,1-2H3
InChI Key
GZYVQZUCADDBKF-UHFFFAOYSA-N
Formula
C13H18O2S
SMILES
CCCOC(=O)c1ccc(SCCC)cc1
Molecular Weight1
238.35
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Physical Properties

Property Value Unit Source
Δf -39.44 kJ/mol Joback Calculated Property
Δfgas -289.52 kJ/mol Joback Calculated Property
Δfus 29.99 kJ/mol Joback Calculated Property
Δvap 63.44 kJ/mol Joback Calculated Property
log10WS -4.13 Crippen Calculated Property
logPoct/wat 3.756 Crippen Calculated Property
McVol 194.060 ml/mol McGowan Calculated Property
Pc 2295.91 kPa Joback Calculated Property
Inp 1910.00 NIST
Tboil 673.57 K Joback Calculated Property
Tc 893.32 K Joback Calculated Property
Tfus 381.77 K Joback Calculated Property
Vc 0.734 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [499.32; 576.85] J/mol×K [673.57; 893.32] Show Hide
Cp,gas 499.32 J/mol×K 673.57 Joback Calculated Property
Cp,gas 514.64 J/mol×K 710.20 Joback Calculated Property
Cp,gas 528.98 J/mol×K 746.82 Joback Calculated Property
Cp,gas 542.35 J/mol×K 783.45 Joback Calculated Property
Cp,gas 554.78 J/mol×K 820.07 Joback Calculated Property
Cp,gas 566.27 J/mol×K 856.70 Joback Calculated Property
Cp,gas 576.85 J/mol×K 893.32 Joback Calculated Property

Similar Compounds

Benzoic acid, 4-(butylthio)-, butyl ester. Benzoic acid, 4-(2-methylpropyl)thio-, 2-methylpropyl ester. Benzoic acid, 3-(propylthio)-, propyl ester. Benzoic acid, 4-(methylthio)-, propyl ester. Benzoic acid, 4-(pentylthio)-, pentyl ester. Benzoic acid, 4-(1-methylpropyl)thio)-, 1-methylpropyl ester. Benzoic acid, 2-(propylthio)-, propyl ester. Benzoic acid, 4-(3-methylbutyl)thio-, 3-methylbutyl ester. Benzoic acid, 4-(ethylthio)-, ethyl ester. Benzoic acid, 3-(2-methylpropyl)thio-, 2-methylpropyl ester. Benzoic acid, 3-(butylthio)-, butyl ester. Benzoic acid, 4-(methylthio)-, butyl ester. Benzoic acid, 4-(2-methylbutyl)thio-, 2-methylbutyl ester. Benzoic acid, 2-(2-methylpropyl)thio-, 2-methylpropyl ester. Benzoic acid, 4-(methylthio)-, 2-methylpropyl ester.

Find more compounds similar to Benzoic acid, 4-(propylthio)-, propyl ester.

Sources

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