Chemical Properties of Succinic acid, di(2-nitrophenethyl) ester

InChI

InChI=1S/C20H20N2O8/c23-19(29-13-11-15-5-1-3-7-17(15)21(25)26)9-10-20(24)30-14-12-16-6-2-4-8-18(16)22(27)28/h1-8H,9-14H2

InChI Key

UEIXLFSAXGBMQM-UHFFFAOYSA-N

Formula

C20H20N2O8

SMILES

O=C(CCC(=O)OCCc1ccccc1[N+](=O)[O-])OCCc1ccccc1[N+](=O)[O-]

Molecular Weight¹

416.38

• 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).
• I_np : Non-polar retention indices.
• 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

Property	Value	Unit	Source
ΔfG°	-73.66	kJ/mol	Joback Calculated Property
ΔfH°gas	-517.13	kJ/mol	Joback Calculated Property
ΔfusH°	63.16	kJ/mol	Joback Calculated Property
ΔvapH°	117.48	kJ/mol	Joback Calculated Property
log10WS	-5.43		Crippen Calculated Property
logPoct/wat	3.155		Crippen Calculated Property
McVol	294.860	ml/mol	McGowan Calculated Property
Pc	1750.67	kPa	Joback Calculated Property
Inp	[3340.00; 3340.00]
Inp	3340.00		NIST
Inp	3340.00		NIST
Tboil	1176.58	K	Joback Calculated Property
Tc	1444.76	K	Joback Calculated Property
Tfus	824.58	K	Joback Calculated Property
Vc	1.151	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[951.64; 963.07]	J/mol×K	[1176.58; 1444.76]
Cp,gas	951.64	J/mol×K	1176.58	Joback Calculated Property
Cp,gas	956.69	J/mol×K	1221.28	Joback Calculated Property
Cp,gas	960.22	J/mol×K	1265.97	Joback Calculated Property
Cp,gas	962.33	J/mol×K	1310.67	Joback Calculated Property
Cp,gas	963.07	J/mol×K	1355.37	Joback Calculated Property
Cp,gas	962.54	J/mol×K	1400.07	Joback Calculated Property
Cp,gas	960.80	J/mol×K	1444.76	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, di(2-nitrophenethyl) ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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