Chemical Properties of Phthalic acid, heptyl 2-(methylthio)phenyl ester

Phthalic acid, heptyl 2-(methylthio)phenyl ester

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InChI
InChI=1S/C22H26O4S/c1-3-4-5-6-11-16-25-21(23)17-12-7-8-13-18(17)22(24)26-19-14-9-10-15-20(19)27-2/h7-10,12-15H,3-6,11,16H2,1-2H3
InChI Key
RZKBBCUMYCJRHB-UHFFFAOYSA-N
Formula
C22H26O4S
SMILES
CCCCCCCOC(=O)c1ccccc1C(=O)Oc1ccccc1SC
Molecular Weight1
386.50
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Physical Properties

Property Value Unit Source
Δf -94.80 kJ/mol Joback Calculated Property
Δfgas -495.02 kJ/mol Joback Calculated Property
Δfus 49.74 kJ/mol Joback Calculated Property
Δvap 95.57 kJ/mol Joback Calculated Property
log10WS -7.06 Crippen Calculated Property
logPoct/wat 5.755 Crippen Calculated Property
McVol 304.550 ml/mol McGowan Calculated Property
Pc 1491.89 kPa Joback Calculated Property
Inp [1466.00; 1466.00]   Show Hide
Inp 1466.00 NIST
Inp 1466.00 NIST
Tboil 987.44 K Joback Calculated Property
Tc 1222.87 K Joback Calculated Property
Tfus 594.30 K Joback Calculated Property
Vc 1.153 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [948.79; 998.69] J/mol×K [987.44; 1222.87] Show Hide
Cp,gas 948.79 J/mol×K 987.44 Joback Calculated Property
Cp,gas 960.87 J/mol×K 1026.68 Joback Calculated Property
Cp,gas 971.40 J/mol×K 1065.92 Joback Calculated Property
Cp,gas 980.42 J/mol×K 1105.16 Joback Calculated Property
Cp,gas 987.94 J/mol×K 1144.40 Joback Calculated Property
Cp,gas 994.03 J/mol×K 1183.64 Joback Calculated Property
Cp,gas 998.69 J/mol×K 1222.87 Joback Calculated Property

Similar Compounds

Phthalic acid, hexyl 2-(methylthio)phenyl ester. Phthalic acid, 2-(methylthio)phenyl pentyl ester. Phthalic acid, butyl 2-(methylthio)phenyl ester. Phthalic acid, dodecyl 4-methylthiophenyl ester. Phthalic acid, 2-(methylthio)phenyl propyl ester. Phthalic acid, isobutyl 2-(methylthio)phenyl ester. Phthalic acid, 3-fluorophenyl tridecyl ester. Phthalic acid, 3-fluorophenyl pentadecyl ester. Phthalic acid, dodecyl 3-fluorophenyl ester. Phthalic acid, 3-fluorophenyl tetradecyl ester. Phthalic acid, 3-fluorophenyl hexadecyl ester. Phthalic acid, decyl 3-fluorophenyl ester. Phthalic acid, 3-fluorophenyl nonyl ester. Phthalic acid, 3-fluorophenyl octyl ester. Phthalic acid, 3-fluorophenyl undecyl ester.

Find more compounds similar to Phthalic acid, heptyl 2-(methylthio)phenyl ester.

Sources

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