Chemical Properties of Benzoic acid, 4-(methylthio)-, ethyl ester

Benzoic acid, 4-(methylthio)-, ethyl ester

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InChI
InChI=1S/C10H12O2S/c1-3-12-10(11)8-4-6-9(13-2)7-5-8/h4-7H,3H2,1-2H3
InChI Key
URNLGRVTEGNSHT-UHFFFAOYSA-N
Formula
C10H12O2S
SMILES
CCOC(=O)c1ccc(SC)cc1
Molecular Weight1
196.27
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Physical Properties

Property Value Unit Source
Δf -64.70 kJ/mol Joback Calculated Property
Δfgas -227.60 kJ/mol Joback Calculated Property
Δfus 22.23 kJ/mol Joback Calculated Property
Δvap 56.77 kJ/mol Joback Calculated Property
log10WS -2.88 Crippen Calculated Property
logPoct/wat 2.585 Crippen Calculated Property
McVol 151.790 ml/mol McGowan Calculated Property
Pc 3089.85 kPa Joback Calculated Property
Inp [1651.00; 1651.00]   Show Hide
Inp 1651.00 NIST
Inp 1651.00 NIST
Tboil 604.93 K Joback Calculated Property
Tc 837.42 K Joback Calculated Property
Tfus 347.96 K Joback Calculated Property
Vc 0.566 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [350.05; 417.88] J/mol×K [604.93; 837.42] Show Hide
Cp,gas 350.05 J/mol×K 604.93 Joback Calculated Property
Cp,gas 363.45 J/mol×K 643.68 Joback Calculated Property
Cp,gas 376.01 J/mol×K 682.43 Joback Calculated Property
Cp,gas 387.72 J/mol×K 721.18 Joback Calculated Property
Cp,gas 398.60 J/mol×K 759.92 Joback Calculated Property
Cp,gas 408.65 J/mol×K 798.67 Joback Calculated Property
Cp,gas 417.88 J/mol×K 837.42 Joback Calculated Property

Similar Compounds

Benzoic acid, 4-(ethylthio)-, ethyl ester. Benzoic acid, 4-(methylthio)-, isopropyl ester. Benzoic acid, 4-(methylthio)-, propyl ester. 4-Mercaptobenzoic acid, S-methyl-, methyl ester. 4-(Methylthio)benzoic acetic anhydride. Benzoic acid, 4-(methylthio)-, 2-methylpropyl ester. Benzoic acid, 4-(methylthio)-, butyl ester. Benzoic acid, 3-(methylthio)-, ethyl ester. 4-(Methylthio)benzoic trifluoroacetic anhydride. Benzoic acid, 4-(methylthio)-, 1-methylpropyl ester. Benzoic acid, 4-(methylthio)-, pentyl ester. Benzoic acid, 4-(isopropylthio)-, isopropyl ester. Benzoic acid, 4-(methylthio)-, 3-methylbutyl ester. Benzoic acid, 2-(methylthio)-, ethyl ester. 4-CH3SO2-C6H4-COOCH3.

Find more compounds similar to Benzoic acid, 4-(methylthio)-, ethyl ester.

Sources

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