Chemical Properties of medinoterb acetate

InChI

InChI=1S/C13H16N2O6/c1-7-10(14(17)18)6-9(13(3,4)5)12(21-8(2)16)11(7)15(19)20/h6H,1-5H3

InChI Key

LWULXYSYLOIDQY-UHFFFAOYSA-N

Formula

C13H16N2O6

SMILES

CC(=O)Oc1c(C(C)(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-]

Molecular Weight¹

296.28

• 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	[641.61; 690.15]	J/mol×K	[920.18; 1174.94]
Cp,gas	641.61	J/mol×K	920.18	Joback Calculated Property
Cp,gas	652.29	J/mol×K	962.64	Joback Calculated Property
Cp,gas	661.86	J/mol×K	1005.10	Joback Calculated Property
Cp,gas	670.38	J/mol×K	1047.56	Joback Calculated Property
Cp,gas	677.90	J/mol×K	1090.02	Joback Calculated Property
Cp,gas	684.47	J/mol×K	1132.48	Joback Calculated Property
Cp,gas	690.15	J/mol×K	1174.94	Joback Calculated Property

Similar Compounds

Find more compounds similar to medinoterb acetate.

Sources

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

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