Chemical Properties of 5-methyl-5-propyl-1,3-diazinane-2,4,6-trione

InChI

InChI=1S/C8H12N2O3/c1-3-4-8(2)5(11)9-7(13)10-6(8)12/h3-4H2,1-2H3,(H2,9,10,11,12,13)

InChI Key

KWEHOVAGMBSHNZ-UHFFFAOYSA-N

Formula

C8H12N2O3

SMILES

CCCC1(C)C(=O)NC(=O)NC1=O

Molecular Weight¹

184.20

• 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	[387.82; 475.62]	J/mol×K	[702.79; 967.84]
Cp,gas	387.82	J/mol×K	702.79	Joback Calculated Property
Cp,gas	404.44	J/mol×K	746.96	Joback Calculated Property
Cp,gas	420.27	J/mol×K	791.14	Joback Calculated Property
Cp,gas	435.31	J/mol×K	835.31	Joback Calculated Property
Cp,gas	449.56	J/mol×K	879.49	Joback Calculated Property
Cp,gas	462.99	J/mol×K	923.66	Joback Calculated Property
Cp,gas	475.62	J/mol×K	967.84	Joback Calculated Property

Similar Compounds

Find more compounds similar to 5-methyl-5-propyl-1,3-diazinane-2,4,6-trione.

Sources

• Crippen Method
• Joback Method
• Aqueous and cosolvent solubility data for drug-like organic compounds
• McGowan Method

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