Chemical Properties of Benzoic acid, 4-(pentylthio)-, pentyl ester

Benzoic acid, 4-(pentylthio)-, pentyl ester

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InChI
InChI=1S/C17H26O2S/c1-3-5-7-13-19-17(18)15-9-11-16(12-10-15)20-14-8-6-4-2/h9-12H,3-8,13-14H2,1-2H3
InChI Key
ZLLQPBHQBHEWAT-UHFFFAOYSA-N
Formula
C17H26O2S
SMILES
CCCCCOC(=O)c1ccc(SCCCCC)cc1
Molecular Weight1
294.45
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Physical Properties

Property Value Unit Source
Δf -5.76 kJ/mol Joback Calculated Property
Δfgas -372.08 kJ/mol Joback Calculated Property
Δfus 40.35 kJ/mol Joback Calculated Property
Δvap 72.35 kJ/mol Joback Calculated Property
log10WS -5.81 Crippen Calculated Property
logPoct/wat 5.316 Crippen Calculated Property
McVol 250.420 ml/mol McGowan Calculated Property
Pc 1637.78 kPa Joback Calculated Property
Inp [2327.00; 2327.00]   Show Hide
Inp 2327.00 NIST
Inp 2327.00 NIST
Tboil 765.09 K Joback Calculated Property
Tc 973.17 K Joback Calculated Property
Tfus 426.85 K Joback Calculated Property
Vc 0.958 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [716.81; 800.75] J/mol×K [765.09; 973.17] Show Hide
Cp,gas 716.81 J/mol×K 765.09 Joback Calculated Property
Cp,gas 733.45 J/mol×K 799.77 Joback Calculated Property
Cp,gas 749.00 J/mol×K 834.45 Joback Calculated Property
Cp,gas 763.48 J/mol×K 869.13 Joback Calculated Property
Cp,gas 776.91 J/mol×K 903.81 Joback Calculated Property
Cp,gas 789.33 J/mol×K 938.49 Joback Calculated Property
Cp,gas 800.75 J/mol×K 973.17 Joback Calculated Property

Similar Compounds

Benzoic acid, 4-(butylthio)-, butyl ester. Benzoic acid, 3-(pentylthio)-, pentyl ester. Benzoic acid, 2-(pentylthio)-, pentyl ester. Benzoic acid, 4-(3-methylbutyl)thio-, 3-methylbutyl ester. Benzoic acid, 3-(butylthio)-, butyl ester. Benzoic acid, 2-(butylthio)-, butyl ester. Benzoic acid, 4-(2-methylbutyl)thio-, 2-methylbutyl ester. Benzoic acid, 4-(propylthio)-, propyl ester. Benzoic acid, 4-(methylthio)-, pentyl ester. Benzoic acid, 2-(3-methylbutyl)thio-, 3-methylbutyl ester. Benzoic acid, 3-(3-methylbutyl)thio-, 3-methylbutyl ester. Benzoic acid, 3-(2-methylbutyl)thio-, 2-methylbutyl ester. Benzoic acid, 2-(2-methylbutyl)thio-, 2-methylbutyl ester. 4-(Methylthio)benzoic acid, 2-propylpentyl ester. Terephthalic acid, 4-methylthiophenyl pentyl ester.

Find more compounds similar to Benzoic acid, 4-(pentylthio)-, pentyl ester.

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