Chemical Properties of L(-)-3-benzoylamino-4-benzoylmercapto-1-butanol benzoate (CAS 10357-55-8)

L(-)-3-benzoylamino-4-benzoylmercapto-1-butanol benzoate

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InChI
InChI=1S/C25H23NO4S/c27-23(19-10-4-1-5-11-19)26-22(18-31-25(29)21-14-8-3-9-15-21)16-17-30-24(28)20-12-6-2-7-13-20/h1-15,22H,16-18H2,(H,26,27)
InChI Key
TYKGHWYHOPGIRA-UHFFFAOYSA-N
Formula
C25H23NO4S
SMILES
O=C(NC(CCOC(=O)c1ccccc1)CSC(=O)c1ccccc1)c1ccccc1
Molecular Weight1
433.52
CAS
10357-55-8
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Physical Properties

Property Value Unit Source
ΔfG° 125.16 kJ/mol Joback Calculated Property
ΔfH°gas -229.64 kJ/mol Joback Calculated Property
ΔfusH° 54.32 kJ/mol Joback Calculated Property
ΔvapH° 113.58 kJ/mol Joback Calculated Property
log10WS -6.93 Crippen Calculated Property
logPoct/wat 4.606 Crippen Calculated Property
McVol 328.740 ml/mol McGowan Calculated Property
Pc 1714.61 kPa Joback Calculated Property
Tboil 1153.98 K Joback Calculated Property
Tc 1421.64 K Joback Calculated Property
Tfus 694.85 K Joback Calculated Property
Vc 1.230 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1040.72; 1068.53] J/mol×K [1153.98; 1421.64] Show Hide
Cp,gas 1040.72 J/mol×K 1153.98 Joback Calculated Property
Cp,gas 1048.14 J/mol×K 1198.59 Joback Calculated Property
Cp,gas 1054.27 J/mol×K 1243.20 Joback Calculated Property
Cp,gas 1059.23 J/mol×K 1287.81 Joback Calculated Property
Cp,gas 1063.16 J/mol×K 1332.42 Joback Calculated Property
Cp,gas 1066.22 J/mol×K 1377.03 Joback Calculated Property
Cp,gas 1068.53 J/mol×K 1421.64 Joback Calculated Property

Similar Compounds

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Find more compounds similar to L(-)-3-benzoylamino-4-benzoylmercapto-1-butanol benzoate.

Sources

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