Chemical Properties of N,N'-ETHYLENEBIS(N-NITROACETAMIDE)

InChI

InChI=1S/C6H10N4O6/c1-5(11)7(9(13)14)3-4-8(6(2)12)10(15)16/h3-4H2,1-2H3

InChI Key

QYYIAMKTNITMRW-UHFFFAOYSA-N

Formula

C6H10N4O6

SMILES

CC(=O)N(CCN(C(C)=O)[N+](=O)[O-])[N+](=O)[O-]

Molecular Weight¹

234.17

Other Names

• N,N'-dinitro-N,N'-diacetyl-1,2-diaminoethane

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[219.97; 475.43]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			1.75200e+00
Coefficient B			9.64360e-01
Coefficient C			-6.47200e-04
Coefficient D			1.56520e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	219.97	J/mol×K	273.00	Calculated Property
Cp,gas	268.85	J/mol×K	353.78	Calculated Property
Cp,gas	311.45	J/mol×K	434.56	Calculated Property
Cp,gas	348.26	J/mol×K	515.33	Calculated Property
Cp,gas	379.79	J/mol×K	596.11	Calculated Property
Cp,gas	406.53	J/mol×K	676.89	Calculated Property
Cp,gas	428.96	J/mol×K	757.67	Calculated Property
Cp,gas	447.60	J/mol×K	838.44	Calculated Property
Cp,gas	462.92	J/mol×K	919.22	Calculated Property
Cp,gas	475.43	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to N,N'-ETHYLENEBIS(N-NITROACETAMIDE).

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
• Joback Method
• McGowan Method
• NIST Webbook

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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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