Chemical Properties of Succinic acid, naphth-2-ylmethyl 2-ethylbutyl ester

InChI

InChI=1S/C21H26O4/c1-3-16(4-2)14-24-20(22)11-12-21(23)25-15-17-9-10-18-7-5-6-8-19(18)13-17/h5-10,13,16H,3-4,11-12,14-15H2,1-2H3

InChI Key

BZVNGIPJLSUSKB-UHFFFAOYSA-N

Formula

C21H26O4

SMILES

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

Molecular Weight¹

342.43

• ω : Acentric Factor.
• 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).
• 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).
• I_np : Non-polar retention indices.
• 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	0.8761		Relay (1.0) Calculated Property
ΔfusH°	46.03	kJ/mol	Joback Calculated Property
IE	8.02	eV	Relay (1.0) Calculated Property
log10WS	-5.23		Relay (1.0) Calculated Property
logPoct/wat	4.643		Crippen Calculated Property
McVol	278.410	ml/mol	McGowan Calculated Property
Pc	1418.64	kPa	Joback Calculated Property
Inp	[2791.00; 2791.00]
Inp	2791.00		NIST
Inp	2791.00		NIST
Tboil	685.54	K	Relay (1.0) Calculated Property
Tc	912.02	K	Relay (1.0) Calculated Property
Tfus	300.70	K	Relay (1.0) Calculated Property
Vc	1.005	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation 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

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[850.15; 923.33]	J/mol×K	[846.72; 1057.84]
Cp,gas	850.15	J/mol×K	846.72	Joback Calculated Property
Cp,gas	865.20	J/mol×K	881.91	Joback Calculated Property
Cp,gas	879.03	J/mol×K	917.09	Joback Calculated Property
Cp,gas	891.71	J/mol×K	952.28	Joback Calculated Property
Cp,gas	903.28	J/mol×K	987.47	Joback Calculated Property
Cp,gas	913.80	J/mol×K	1022.65	Joback Calculated Property
Cp,gas	923.33	J/mol×K	1057.84	Joback Calculated Property
η	[0.0000660; 0.0009523]	Pa×s	[467.73; 846.72]
η	0.0009523	Pa×s	467.73	Joback Calculated Property
η	0.0004684	Pa×s	530.89	Joback Calculated Property
η	0.0002679	Pa×s	594.06	Joback Calculated Property
η	0.0001706	Pa×s	657.23	Joback Calculated Property
η	0.0001176	Pa×s	720.39	Joback Calculated Property
η	0.0000860	Pa×s	783.56	Joback Calculated Property
η	0.0000660	Pa×s	846.72	Joback Calculated Property

Similar Compounds

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

Sources

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

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