Chemical Properties of bis-(Dimethylaminomethyl) sulfide

InChI

InChI=1S/C4H12N2S/c1-5(2)7-6(3)4/h1-4H3

InChI Key

KOCBDXPTBPQDIB-UHFFFAOYSA-N

Formula

C4H12N2S

SMILES

CN(C)SN(C)C

Molecular Weight¹

120.22

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[141.86; 328.34]	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			-2.53000e+00
Coefficient B			6.26070e-01
Coefficient C			-3.78800e-04
Coefficient D			8.36000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	141.86	J/mol×K	273.00	Calculated Property
Cp,gas	175.25	J/mol×K	353.78	Calculated Property
Cp,gas	204.86	J/mol×K	434.56	Calculated Property
Cp,gas	230.95	J/mol×K	515.33	Calculated Property
Cp,gas	253.78	J/mol×K	596.11	Calculated Property
Cp,gas	273.62	J/mol×K	676.89	Calculated Property
Cp,gas	290.73	J/mol×K	757.67	Calculated Property
Cp,gas	305.38	J/mol×K	838.44	Calculated Property
Cp,gas	317.83	J/mol×K	919.22	Calculated Property
Cp,gas	328.34	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to bis-(Dimethylaminomethyl) sulfide.

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

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