Chemical Properties of DICYCLOHEXYLSULPHIDE

InChI

InChI=1S/C12H22S/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h11-12H,1-10H2

InChI Key

FTAORUVBXKFVDA-UHFFFAOYSA-N

Formula

C12H22S

SMILES

C1CCC(SC2CCCCC2)CC1

Molecular Weight¹

198.38

Other Names

• Cyclohexane, 1,1'-thiobis-
• Dicyclohexyl sulfide

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• ρ_c : Critical density (kg/m³).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[454.79; 582.85]	J/mol×K	[581.84; 834.84]
Cp,gas	454.79	J/mol×K	581.84	Joback Calculated Property
Cp,gas	480.58	J/mol×K	624.01	Joback Calculated Property
Cp,gas	504.51	J/mol×K	666.17	Joback Calculated Property
Cp,gas	526.65	J/mol×K	708.34	Joback Calculated Property
Cp,gas	547.05	J/mol×K	750.50	Joback Calculated Property
Cp,gas	565.76	J/mol×K	792.67	Joback Calculated Property
Cp,gas	582.85	J/mol×K	834.84	Joback Calculated Property
ΔfusH	5.68	kJ/mol	284.20	NIST
ΔvapH	[53.70; 65.40]	kJ/mol	[429.00; 429.00]
ΔvapH	65.40 ± 0.20	kJ/mol	429.00	NIST
ΔvapH	62.50 ± 0.10	kJ/mol	429.00	NIST
ΔvapH	59.50 ± 0.10	kJ/mol	429.00	NIST
ΔvapH	56.60 ± 0.10	kJ/mol	429.00	NIST
ΔvapH	53.70 ± 0.10	kJ/mol	429.00	NIST

Similar Compounds

Find more compounds similar to DICYCLOHEXYLSULPHIDE.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Possible precursors and products of deep hydrodesulfurization of gasoline and distillate fuels IV. Heat capacities, enthalpy increments, vapor pressures, and derived thermodynamic functions for dicyclohexylsulfide between the temperatures (5 and 520) K
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.