Chemical Properties of Nitramine, N,N-bis(2-hydroxyethyl)-, nitrate

InChI

InChI=1S/C4H8N4O8/c9-6(10)5(1-3-15-7(11)12)2-4-16-8(13)14/h1-4H2

InChI Key

NZDNCDGEHXHPCO-UHFFFAOYSA-N

Formula

C4H8N4O8

SMILES

O=[N+]([O-])OCCN(CCO[N+](=O)[O-])[N+](=O)[O-]

Molecular Weight¹

240.13

Other Names

• 2,2'-(Nitroimino)ethanol dinitrate
• 2,2'-Dinitrato-N-nitrodiethylamine
• 2,2'-Nitroiminobis(ethylnitrate)
• 2,2'-Nitroiminodiethanol nitrate
• DINA
• DINA (explosive)
• Diethanol-N-nitramine dinitrate
• Diethanolnitramine dinitrate
• Ethanol, 2,2'-(nitroimino)bis-, dinitrate
• Ethanol, 2,2'-(nitroimino)bis-, dinitrate (ester)
• Ethanol, 2,2'-nitroiminodi-, dinitrate
• N-Nitrodiethanolamine dinitrate
• Nitrodiethanolamine dinitrate
• sym-Dinitroxydiethylnitramine

• Δ_cH°_liquid : Standard liquid enthalpy of combustion (kJ/mol).
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_solid : Solid phase 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

Property	Value	Unit	Source
ΔcH°liquid	-2459.90	kJ/mol	NIST
ΔcH°solid	[-2410.60; -2400.00]	kJ/mol
ΔcH°solid	-2400.00	kJ/mol	NIST
ΔcH°solid	-2410.60 ± 1.50	kJ/mol	NIST
ΔcH°solid	-2407.00	kJ/mol	NIST
ΔcH°solid	-2409.90	kJ/mol	NIST
ΔfH°gas	-155.17	kJ/mol	Relay (1.0) Calculated Property
ΔfH°liquid	[-257.42; -224.00]	kJ/mol
ΔfH°liquid	-257.42	kJ/mol	NIST
ΔfH°liquid	-224.00	kJ/mol	NIST
ΔfH°liquid	-224.00	kJ/mol	NIST
ΔfH°solid	[-311.00; -306.80]	kJ/mol
ΔfH°solid	-306.80 ± 1.50	kJ/mol	NIST
ΔfH°solid	-311.00	kJ/mol	NIST
ΔfH°solid	-307.50	kJ/mol	NIST
ΔfusH°	45.60	kJ/mol	Joback Calculated Property
ΔvapH°	91.40	kJ/mol	Relay (1.0) Calculated Property
IE	10.73	eV	Relay (1.0) Calculated Property
log10WS	-2.08		Relay (1.0) Calculated Property
logPoct/wat	-1.103		Crippen Calculated Property
McVol	141.200	ml/mol	McGowan Calculated Property
Tboil	523.03	K	Relay (1.0) Calculated Property
Tfus	324.63	K	Relay (1.0) Calculated Property

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	[407.87; 444.27]	J/mol×K	[803.72; 1049.18]
Cp,gas	407.87	J/mol×K	803.72	Joback Calculated Property
Cp,gas	416.08	J/mol×K	844.63	Joback Calculated Property
Cp,gas	423.42	J/mol×K	885.54	Joback Calculated Property
Cp,gas	429.90	J/mol×K	926.45	Joback Calculated Property
Cp,gas	435.53	J/mol×K	967.36	Joback Calculated Property
Cp,gas	440.31	J/mol×K	1008.27	Joback Calculated Property
Cp,gas	444.27	J/mol×K	1049.18	Joback Calculated Property

Similar Compounds

Find more compounds similar to Nitramine, N,N-bis(2-hydroxyethyl)-, nitrate.

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.