Chemical Properties of Butanedioic acid, phenyl-

InChI

InChI=1S/C10H10O4/c11-9(12)6-8(10(13)14)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,11,12)(H,13,14)

InChI Key

LVFFZQQWIZURIO-UHFFFAOYSA-N

Formula

C10H10O4

SMILES

O=C(O)CC(C(=O)O)c1ccccc1

Molecular Weight¹

194.19

Other Names

• Succinic acid, phenyl-
• «alpha»-Phenylsuccinic acid
• Phenylsuccinic acid
• 2-Phenylsuccinic acid
• dl-Phenylsuccinic acid

• 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_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (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, Enthalpy of formation at standard conditions, 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[187.29; 438.81]	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			-3.25890e+01
Coefficient B			9.82400e-01
Coefficient C			-6.99800e-04
Coefficient D			1.88800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	187.29	J/mol×K	273.00	Calculated Property
Cp,gas	235.74	J/mol×K	353.78	Calculated Property
Cp,gas	277.66	J/mol×K	434.56	Calculated Property
Cp,gas	313.67	J/mol×K	515.33	Calculated Property
Cp,gas	344.35	J/mol×K	596.11	Calculated Property
Cp,gas	370.31	J/mol×K	676.89	Calculated Property
Cp,gas	392.13	J/mol×K	757.67	Calculated Property
Cp,gas	410.43	J/mol×K	838.44	Calculated Property
Cp,gas	425.79	J/mol×K	919.22	Calculated Property
Cp,gas	438.81	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0006413; 0.0001992]	Pa×s	[535.08; 684.82]	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			-1.26992e+01
Coefficient B			2.86116e+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.			535.08
Temperature range, max.			684.82
η	0.0006413	Pa×s	535.08	Calculated Property
η	0.0005458	Pa×s	551.72	Calculated Property
η	0.0004689	Pa×s	568.36	Calculated Property
η	0.0004064	Pa×s	584.99	Calculated Property
η	0.0003550	Pa×s	601.63	Calculated Property
η	0.0003123	Pa×s	618.27	Calculated Property
η	0.0002767	Pa×s	634.91	Calculated Property
η	0.0002466	Pa×s	651.54	Calculated Property
η	0.0002210	Pa×s	668.18	Calculated Property
η	0.0001992	Pa×s	684.82	Calculated Property

Similar Compounds

Find more compounds similar to Butanedioic acid, phenyl-.

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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