Chemical Properties of (Phenylthio)acetic acid, butyl ester

(Phenylthio)acetic acid, butyl ester

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InChI
InChI=1S/C12H16O2S/c1-2-3-9-14-12(13)10-15-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3
InChI Key
MPGIAEVWEVYNKM-UHFFFAOYSA-N
Formula
C12H16O2S
SMILES
CCCCOC(=O)CSc1ccccc1
Molecular Weight1
224.32
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Physical Properties

Property Value Unit Source
Δf -38.23 kJ/mol Joback Calculated Property
Δfgas -257.41 kJ/mol Joback Calculated Property
Δfus 27.79 kJ/mol Joback Calculated Property
Δvap 60.55 kJ/mol Joback Calculated Property
log10WS -3.17 Crippen Calculated Property
logPoct/wat 3.122 Crippen Calculated Property
McVol 179.970 ml/mol McGowan Calculated Property
Pc 2561.10 kPa Joback Calculated Property
Inp 1672.00 NIST
Tboil 645.71 K Joback Calculated Property
Tc 868.50 K Joback Calculated Property
Tfus 357.98 K Joback Calculated Property
Vc 0.677 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [448.90; 524.52] J/mol×K [645.71; 868.50] Show Hide
Cp,gas 448.90 J/mol×K 645.71 Joback Calculated Property
Cp,gas 463.89 J/mol×K 682.84 Joback Calculated Property
Cp,gas 477.90 J/mol×K 719.97 Joback Calculated Property
Cp,gas 490.95 J/mol×K 757.11 Joback Calculated Property
Cp,gas 503.05 J/mol×K 794.24 Joback Calculated Property
Cp,gas 514.24 J/mol×K 831.37 Joback Calculated Property
Cp,gas 524.52 J/mol×K 868.50 Joback Calculated Property

Similar Compounds

(Phenylthio)acetic acid, pentyl ester. (Phenylthio)acetic acid, heptyl ester. (Phenylthio)acetic acid, hexyl ester. (Phenylthio)acetic acid, tridecyl ester. (Phenylthio)acetic acid, undecyl ester. (Phenylthio)acetic acid, decyl ester. (Phenylthio)acetic acid, nonyl ester. (Phenylthio) acetic acid, octadecyl ester. (Phenylthio)acetic acid, hexadecyl ester. (Phenylthio)acetic acid, dodecyl ester. (Phenylthio)acetic acid, heptadecyl ester. (Phenylthio)acetic acid, tetradecyl ester. (Phenylthio)acetic acid, pentadecyl ester. (Phenylthio)acetic acid, octyl ester. (Phenylthio)acetic acid, propyl ester.

Find more compounds similar to (Phenylthio)acetic acid, butyl ester.

Sources

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