Chemical Properties of ETHANEDIOIC ACID, DIPHENYL ESTER

InChI

InChI=1S/C14H10O4/c15-13(17-11-7-3-1-4-8-11)14(16)18-12-9-5-2-6-10-12/h1-10H

InChI Key

ULOZDEVJRTYKFE-UHFFFAOYSA-N

Formula

C14H10O4

SMILES

O=C(Oc1ccccc1)C(=O)Oc1ccccc1

Molecular Weight¹

242.23

Other Names

• Oxalic acid, diphenyl ester

• ω : Acentric Factor.
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : 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_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_subH° : Enthalpy of sublimation 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).
• 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

Property	Value	Unit	Source
ω	0.7034		Relay (1.0) Calculated Property
ΔcH°solid	-6399.00 ± 3.00	kJ/mol	NIST
ΔfG°	-328.92	kJ/mol	Joback Calculated Property
ΔfH°gas	-437.20 ± 9.20	kJ/mol	NIST
ΔfH°solid	-540.00 ± 3.00	kJ/mol	NIST
ΔfusH°	28.84	kJ/mol	Joback Calculated Property
ΔsubH°	[102.80; 103.00]	kJ/mol
ΔsubH°	103.00 ± 8.40	kJ/mol	NIST
ΔsubH°	102.80	kJ/mol	NIST
ΔvapH°	93.71	kJ/mol	Relay (1.0) Calculated Property
IE	7.94	eV	NIST
log10WS	-3.83		Relay (1.0) Calculated Property
logPoct/wat	2.198		Crippen Calculated Property
McVol	175.480	ml/mol	McGowan Calculated Property
Pc	2799.47	kPa	Joback Calculated Property
Tboil	595.78	K	Relay (1.0) Calculated Property
Tc	858.15	K	Relay (1.0) Calculated Property
Tfus	361.51	K	Relay (1.0) Calculated Property
Vc	0.651	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[220.64; 520.77]	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			-2.68300e+01
Coefficient B			1.06640e+00
Coefficient C			-6.11000e-04
Coefficient D			9.22000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	220.64	J/mol×K	273.00	Calculated Property
Cp,gas	278.05	J/mol×K	353.78	Calculated Property
Cp,gas	328.77	J/mol×K	434.56	Calculated Property
Cp,gas	373.08	J/mol×K	515.33	Calculated Property
Cp,gas	411.28	J/mol×K	596.11	Calculated Property
Cp,gas	443.65	J/mol×K	676.89	Calculated Property
Cp,gas	470.50	J/mol×K	757.67	Calculated Property
Cp,gas	492.11	J/mol×K	838.44	Calculated Property
Cp,gas	508.77	J/mol×K	919.22	Calculated Property
Cp,gas	520.77	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0016412; 0.0001183]	Pa×s	[385.04; 651.74]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.28401e+01
Coefficient B			2.47496e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			385.04
Temperature range, max.			651.74
η	0.0016412	Pa×s	385.04	Calculated Property
η	0.0010368	Pa×s	414.67	Calculated Property
η	0.0006963	Pa×s	444.31	Calculated Property
η	0.0004915	Pa×s	473.94	Calculated Property
η	0.0003615	Pa×s	503.57	Calculated Property
η	0.0002751	Pa×s	533.20	Calculated Property
η	0.0002154	Pa×s	562.84	Calculated Property
η	0.0001729	Pa×s	592.47	Calculated Property
η	0.0001417	Pa×s	622.10	Calculated Property
η	0.0001183	Pa×s	651.74	Calculated Property

Similar Compounds

Find more compounds similar to ETHANEDIOIC ACID, DIPHENYL ESTER.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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