Chemical Properties of 5,5-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

InChI

InChI=1S/C8H12N2O2S/c1-3-8(4-2)5(11)9-7(13)10-6(8)12/h3-4H2,1-2H3,(H2,9,10,11,12,13)

InChI Key

QGVNJRROSLYGKF-UHFFFAOYSA-N

Formula

C8H12N2O2S

SMILES

CCC1(CC)C(=O)NC(=S)NC1=O

Molecular Weight¹

200.26

• 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).
• 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	[388.29; 470.28]	J/mol×K	[707.61; 976.26]
Cp,gas	388.29	J/mol×K	707.61	Joback Calculated Property
Cp,gas	403.21	J/mol×K	752.39	Joback Calculated Property
Cp,gas	417.51	J/mol×K	797.16	Joback Calculated Property
Cp,gas	431.28	J/mol×K	841.94	Joback Calculated Property
Cp,gas	444.61	J/mol×K	886.71	Joback Calculated Property
Cp,gas	457.58	J/mol×K	931.49	Joback Calculated Property
Cp,gas	470.28	J/mol×K	976.26	Joback Calculated Property

Similar Compounds

Find more compounds similar to 5,5-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione.

Sources

• Crippen Method
• Joback Method
• Aqueous Solubility Prediction Method
• McGowan Method

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