Chemical Properties of Succinic acid, di(4-methylthiophenyl) ester

InChI

InChI=1S/C18H18O4S2/c1-23-15-7-3-13(4-8-15)21-17(19)11-12-18(20)22-14-5-9-16(24-2)10-6-14/h3-10H,11-12H2,1-2H3

InChI Key

NJPWAHMYTFAMHX-UHFFFAOYSA-N

Formula

C18H18O4S2

SMILES

CSc1ccc(OC(=O)CCC(=O)Oc2ccc(SC)cc2)cc1

Molecular Weight¹

362.46

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	-95.36	kJ/mol	Joback Calculated Property
ΔfH°gas	-370.59	kJ/mol	Joback Calculated Property
ΔfusH°	43.51	kJ/mol	Joback Calculated Property
ΔvapH°	93.48	kJ/mol	Joback Calculated Property
log10WS	-5.24		Crippen Calculated Property
logPoct/wat	4.422		Crippen Calculated Property
McVol	264.540	ml/mol	McGowan Calculated Property
Pc	2088.84	kPa	Joback Calculated Property
Inp	[3126.00; 3126.00]
Inp	3126.00		NIST
Inp	3126.00		NIST
Tboil	964.70	K	Joback Calculated Property
Tc	1219.43	K	Joback Calculated Property
Tfus	583.62	K	Joback Calculated Property
Vc	0.984	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[764.70; 798.34]	J/mol×K	[964.70; 1219.43]
Cp,gas	764.70	J/mol×K	964.70	Joback Calculated Property
Cp,gas	774.60	J/mol×K	1007.15	Joback Calculated Property
Cp,gas	782.76	J/mol×K	1049.61	Joback Calculated Property
Cp,gas	789.21	J/mol×K	1092.06	Joback Calculated Property
Cp,gas	793.95	J/mol×K	1134.52	Joback Calculated Property
Cp,gas	796.99	J/mol×K	1176.97	Joback Calculated Property
Cp,gas	798.34	J/mol×K	1219.43	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, di(4-methylthiophenyl) ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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