Chemical Properties of 2-methyl-3,5-dinitrobenzamide

InChI

InChI=1S/C8H7N3O5/c1-4-6(8(9)12)2-5(10(13)14)3-7(4)11(15)16/h2-3H,1H3,(H2,9,12)

InChI Key

ZEFNOZRLAWVAQF-UHFFFAOYSA-N

Formula

C8H7N3O5

SMILES

Cc1c(C(N)=O)cc([N+](=O)[O-])cc1[N+](=O)[O-]

Molecular Weight¹

225.16

Other Names

• 3,5-dinitro-2-methylbenzamide
• 3,5-dinitro-o-toluamide
• 3,5-dinitro-ortho-toluamide
• Dinitolmide

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[399.68; 434.53]	J/mol×K	[854.14; 1128.72]
Cp,gas	399.68	J/mol×K	854.14	Joback Calculated Property
Cp,gas	407.61	J/mol×K	899.90	Joback Calculated Property
Cp,gas	414.64	J/mol×K	945.67	Joback Calculated Property
Cp,gas	420.80	J/mol×K	991.43	Joback Calculated Property
Cp,gas	426.14	J/mol×K	1037.19	Joback Calculated Property
Cp,gas	430.70	J/mol×K	1082.96	Joback Calculated Property
Cp,gas	434.53	J/mol×K	1128.72	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-methyl-3,5-dinitrobenzamide.

Mixtures

• Methyl Alcohol + 2-methyl-3,5-dinitrobenzamide
• Ethanol + 2-methyl-3,5-dinitrobenzamide
• 1-Propanol + 2-methyl-3,5-dinitrobenzamide
• 2-Propanol + 2-methyl-3,5-dinitrobenzamide
• 1-Butanol + 2-methyl-3,5-dinitrobenzamide
• Ethyl Acetate + 2-methyl-3,5-dinitrobenzamide
• Dimethyl Sulfoxide + 2-methyl-3,5-dinitrobenzamide
• Acetonitrile + 2-methyl-3,5-dinitrobenzamide
• Cyclohexane + 2-methyl-3,5-dinitrobenzamide
• 1,2-Ethanediol + 2-methyl-3,5-dinitrobenzamide
• 1,4-Dioxane + 2-methyl-3,5-dinitrobenzamide
• Water + 2-methyl-3,5-dinitrobenzamide
• Ethanol + Water + 2-methyl-3,5-dinitrobenzamide
• 1,2-Ethanediol + Water + 2-methyl-3,5-dinitrobenzamide
• 2-Propanol + Water + 2-methyl-3,5-dinitrobenzamide

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
• Equilibrium solubility of dinitolmide in several neat solvents and binary aqueous co-solvent mixtures: Experimental determination and thermodynamic analysis
• Joback Method
• McGowan Method

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