Chemical Properties of 1,4-Dihydronaphthalene-1,4-dicarboxylic acid (CAS 18274-34-5)

InChI

InChI=1S/C12H10O4/c13-11(14)9-5-6-10(12(15)16)8-4-2-1-3-7(8)9/h1-6,9-10H,(H,13,14)(H,15,16)

InChI Key

FMPOSZITAILTAE-UHFFFAOYSA-N

Formula

C12H10O4

SMILES

O=C(O)C1C=CC(C(=O)O)c2ccccc21

Molecular Weight¹

218.21

CAS

18274-34-5

• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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	[200.04; 495.29]	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			-6.00700e+01
Coefficient B			1.16580e+00
Coefficient C			-8.44040e-04
Coefficient D			2.33600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	200.04	J/mol×K	273.00	Calculated Property
Cp,gas	257.07	J/mol×K	353.78	Calculated Property
Cp,gas	306.32	J/mol×K	434.56	Calculated Property
Cp,gas	348.52	J/mol×K	515.33	Calculated Property
Cp,gas	384.43	J/mol×K	596.11	Calculated Property
Cp,gas	414.77	J/mol×K	676.89	Calculated Property
Cp,gas	440.29	J/mol×K	757.67	Calculated Property
Cp,gas	461.73	J/mol×K	838.44	Calculated Property
Cp,gas	479.81	J/mol×K	919.22	Calculated Property
Cp,gas	495.29	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0009343; 0.0004547]	Pa×s	[596.08; 731.80]	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			-1.08586e+01
Coefficient B			2.31448e+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.			596.08
Temperature range, max.			731.80
η	0.0009343	Pa×s	596.08	Calculated Property
η	0.0008489	Pa×s	611.16	Calculated Property
η	0.0007750	Pa×s	626.24	Calculated Property
η	0.0007104	Pa×s	641.32	Calculated Property
η	0.0006539	Pa×s	656.40	Calculated Property
η	0.0006041	Pa×s	671.48	Calculated Property
η	0.0005601	Pa×s	686.56	Calculated Property
η	0.0005209	Pa×s	701.64	Calculated Property
η	0.0004860	Pa×s	716.72	Calculated Property
η	0.0004547	Pa×s	731.80	Calculated Property

Similar Compounds

Find more compounds similar to 1,4-Dihydronaphthalene-1,4-dicarboxylic acid.

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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