Chemical Properties of Succinic acid, naphth-2-ylmethyl 1-phenylpropyl ester

InChI

InChI=1S/C24H24O4/c1-2-22(20-9-4-3-5-10-20)28-24(26)15-14-23(25)27-17-18-12-13-19-8-6-7-11-21(19)16-18/h3-13,16,22H,2,14-15,17H2,1H3

InChI Key

HLLCKTLNMPYUDF-UHFFFAOYSA-N

Formula

C24H24O4

SMILES

CCC(OC(=O)CCC(=O)OCc1ccc2ccccc2c1)c1ccccc1

Molecular Weight¹

376.45

• 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).
• IE : Ionization energy (eV).
• 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°	47.84	kJ/mol	Joback Calculated Property
IE	8.08	eV	Relay (1.0) Calculated Property
logPoct/wat	5.358		Crippen Calculated Property
McVol	296.920	ml/mol	McGowan Calculated Property
Inp	[3047.00; 3047.00]
Inp	3047.00		NIST
Inp	3047.00		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, 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	[394.01; 943.39]	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			-5.47460e+01
Coefficient B			1.95912e+00
Coefficient C			-1.22788e-03
Coefficient D			2.66900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	394.01	J/mol×K	273.00	Calculated Property
Cp,gas	496.49	J/mol×K	353.78	Calculated Property
Cp,gas	586.63	J/mol×K	434.56	Calculated Property
Cp,gas	665.29	J/mol×K	515.33	Calculated Property
Cp,gas	733.32	J/mol×K	596.11	Calculated Property
Cp,gas	791.55	J/mol×K	676.89	Calculated Property
Cp,gas	840.83	J/mol×K	757.67	Calculated Property
Cp,gas	882.00	J/mol×K	838.44	Calculated Property
Cp,gas	915.90	J/mol×K	919.22	Calculated Property
Cp,gas	943.39	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0005961; 0.0000724]	Pa×s	[527.96; 822.97]	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			-1.33072e+01
Coefficient B			3.10556e+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.			527.96
Temperature range, max.			822.97
η	0.0005961	Pa×s	527.96	Calculated Property
η	0.0004227	Pa×s	560.74	Calculated Property
η	0.0003113	Pa×s	593.52	Calculated Property
η	0.0002367	Pa×s	626.30	Calculated Property
η	0.0001850	Pa×s	659.07	Calculated Property
η	0.0001480	Pa×s	691.85	Calculated Property
η	0.0001208	Pa×s	724.63	Calculated Property
η	0.0001003	Pa×s	757.41	Calculated Property
η	0.0000846	Pa×s	790.19	Calculated Property
η	0.0000724	Pa×s	822.97	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, naphth-2-ylmethyl 1-phenylpropyl 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

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