Chemical Properties of Succinic acid, naphth-2-ylmethyl 2,4,4-trimethylpentyl ester

InChI

InChI=1S/C23H30O4/c1-17(14-23(2,3)4)15-26-21(24)11-12-22(25)27-16-18-9-10-19-7-5-6-8-20(19)13-18/h5-10,13,17H,11-12,14-16H2,1-4H3

InChI Key

RDUJPXIIGWVAFY-UHFFFAOYSA-N

Formula

C23H30O4

SMILES

CC(COC(=O)CCC(=O)OCc1ccc2ccccc2c1)CC(C)(C)C

Molecular Weight¹

370.48

• 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).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	43.80	kJ/mol	Joback Calculated Property
logPoct/wat	5.279		Crippen Calculated Property
McVol	306.590	ml/mol	McGowan Calculated Property
Inp	[2761.00; 2761.00]
Inp	2761.00		NIST
Inp	2761.00		NIST

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	[428.59; 1011.80]	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			-4.44050e+01
Coefficient B			2.06888e+00
Coefficient C			-1.31408e-03
Coefficient D			3.01400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	428.59	J/mol×K	273.00	Calculated Property
Cp,gas	536.40	J/mol×K	353.78	Calculated Property
Cp,gas	631.22	J/mol×K	434.56	Calculated Property
Cp,gas	714.03	J/mol×K	515.33	Calculated Property
Cp,gas	785.77	J/mol×K	596.11	Calculated Property
Cp,gas	847.39	J/mol×K	676.89	Calculated Property
Cp,gas	899.85	J/mol×K	757.67	Calculated Property
Cp,gas	944.10	J/mol×K	838.44	Calculated Property
Cp,gas	981.10	J/mol×K	919.22	Calculated Property
Cp,gas	1011.80	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007161; 0.0000667]	Pa×s	[492.69; 773.97]	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			-1.37742e+01
Coefficient B			3.21852e+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.			492.69
Temperature range, max.			773.97
η	0.0007161	Pa×s	492.69	Calculated Property
η	0.0004850	Pa×s	523.94	Calculated Property
η	0.0003432	Pa×s	555.20	Calculated Property
η	0.0002520	Pa×s	586.45	Calculated Property
η	0.0001909	Pa×s	617.70	Calculated Property
η	0.0001485	Pa×s	648.96	Calculated Property
η	0.0001183	Pa×s	680.21	Calculated Property
η	0.0000961	Pa×s	711.46	Calculated Property
η	0.0000794	Pa×s	742.72	Calculated Property
η	0.0000667	Pa×s	773.97	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, naphth-2-ylmethyl 2,4,4-trimethylpentyl ester.

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.
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