Chemical Properties of 4-oxo-3,4-dihydro-2,3-diazaphenoxathiin

InChI

InChI=1S/C10H8N2O2S/c13-10-9-8(5-11-12-10)15-7-4-2-1-3-6(7)14-9/h1-5,8-9H,(H,12,13)

InChI Key

XHWIEBKKBFMEQX-UHFFFAOYSA-N

Formula

C10H8N2O2S

SMILES

O=C1NN=CC2Sc3ccccc3OC12

Molecular Weight¹

220.25

• 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).
• 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	[410.73; 479.48]	J/mol×K	[725.89; 1022.46]
Cp,gas	410.73	J/mol×K	725.89	Joback Calculated Property
Cp,gas	426.24	J/mol×K	775.32	Joback Calculated Property
Cp,gas	440.09	J/mol×K	824.75	Joback Calculated Property
Cp,gas	452.30	J/mol×K	874.18	Joback Calculated Property
Cp,gas	462.91	J/mol×K	923.61	Joback Calculated Property
Cp,gas	471.96	J/mol×K	973.03	Joback Calculated Property
Cp,gas	479.48	J/mol×K	1022.46	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-oxo-3,4-dihydro-2,3-diazaphenoxathiin.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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