Chemical Properties of 2,2,4-Trimethyl-1,3-dithiane

InChI

InChI=1S/C7H14S2/c1-6-4-5-8-7(2,3)9-6/h6H,4-5H2,1-3H3

InChI Key

FRRBWOYAAOXUHL-UHFFFAOYSA-N

Formula

C7H14S2

SMILES

CC1CCSC(C)(C)S1

Molecular Weight¹

162.32

• ω : Acentric Factor.
• 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).
• 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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[268.58; 354.65]	J/mol×K	[470.34; 716.10]
Cp,gas	268.58	J/mol×K	470.34	Joback Calculated Property
Cp,gas	285.66	J/mol×K	511.30	Joback Calculated Property
Cp,gas	301.45	J/mol×K	552.26	Joback Calculated Property
Cp,gas	316.08	J/mol×K	593.22	Joback Calculated Property
Cp,gas	329.73	J/mol×K	634.18	Joback Calculated Property
Cp,gas	342.54	J/mol×K	675.14	Joback Calculated Property
Cp,gas	354.65	J/mol×K	716.10	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,2,4-Trimethyl-1,3-dithiane.

Sources

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

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