Chemical Properties of trans-1,2-Bis(benzylthio)-ethylene (CAS 788-26-1)

InChI

InChI=1S/C16H16S2/c1-3-7-15(8-4-1)13-17-11-12-18-14-16-9-5-2-6-10-16/h1-12H,13-14H2/b12-11+

InChI Key

RZVCNFNSLCXUMM-VAWYXSNFSA-N

Formula

C16H16S2

SMILES

C(=CSCc1ccccc1)SCc1ccccc1

Molecular Weight¹

272.43

CAS

788-26-1

• ω : Acentric Factor.
• Δ_cH°_gas : Standard gas enthalpy of combustion (kJ/mol).
• 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_fH°_liquid : Liquid phase 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).
• IE : Ionization energy (eV).
• 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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[561.22; 637.35]	J/mol×K	[760.56; 1033.56]
Cp,gas	561.22	J/mol×K	760.56	Joback Calculated Property
Cp,gas	577.37	J/mol×K	806.06	Joback Calculated Property
Cp,gas	591.96	J/mol×K	851.56	Joback Calculated Property
Cp,gas	605.13	J/mol×K	897.06	Joback Calculated Property
Cp,gas	617.01	J/mol×K	942.56	Joback Calculated Property
Cp,gas	627.70	J/mol×K	988.06	Joback Calculated Property
Cp,gas	637.35	J/mol×K	1033.56	Joback Calculated Property

Similar Compounds

Find more compounds similar to trans-1,2-Bis(benzylthio)-ethylene.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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