Chemical Properties of Propane, 2,2'-[methylenebis(thio)]bis[2-methyl-

InChI

InChI=1S/C9H20S2/c1-8(2,3)10-7-11-9(4,5)6/h7H2,1-6H3

InChI Key

HCODNZPTXNCDTN-UHFFFAOYSA-N

Formula

C9H20S2

SMILES

CC(C)(C)SCSC(C)(C)C

Molecular Weight¹

192.39

Other Names

• 2,2,6,6-tetramethyl-3,5-dithiaheptane
• Formaldehyde di-tert-butylmercaptal

• 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_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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point 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 Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[234.49; 539.76]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.50390e+01
Coefficient B			1.09930e+00
Coefficient C			-7.29000e-04
Coefficient D			1.84500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	234.49	J/mol×K	273.00	Calculated Property
Cp,gas	290.80	J/mol×K	353.78	Calculated Property
Cp,gas	340.14	J/mol×K	434.56	Calculated Property
Cp,gas	383.12	J/mol×K	515.33	Calculated Property
Cp,gas	420.30	J/mol×K	596.11	Calculated Property
Cp,gas	452.27	J/mol×K	676.89	Calculated Property
Cp,gas	479.62	J/mol×K	757.67	Calculated Property
Cp,gas	502.93	J/mol×K	838.44	Calculated Property
Cp,gas	522.78	J/mol×K	919.22	Calculated Property
Cp,gas	539.76	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Propane, 2,2'-[methylenebis(thio)]bis[2-methyl-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• 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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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