Chemical Properties of Fumaric acid, 2-(2-methoxyethyl)hexyl 2,3-dichlorophenyl ester

InChI

InChI=1S/C19H24Cl2O5/c1-3-4-6-14(11-12-24-2)13-25-17(22)9-10-18(23)26-16-8-5-7-15(20)19(16)21/h5,7-10,14H,3-4,6,11-13H2,1-2H3/b10-9+

InChI Key

FOUMKUZOUGTVRY-MDZDMXLPSA-N

Formula

C19H24Cl2O5

SMILES

CCCCC(CCOC)COC(=O)C=CC(=O)Oc1cccc(Cl)c1Cl

Molecular Weight¹

403.30

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (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).
• 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	0.9377		Relay (... Calculated Property
ΔfG°	-316.67	kJ/mol	Joback Calculated Property
ΔfH°gas	-885.93	kJ/mol	Relay (... Calculated Property
ΔfusH°	50.06	kJ/mol	Joback Calculated Property
ΔvapH°	108.92	kJ/mol	Relay (... Calculated Property
IE	8.78	eV	Relay (... Calculated Property
log10WS	-5.84		Relay (... Calculated Property
logPoct/wat	4.841		Crippen Calculated Property
McVol	295.740	ml/mol	McGowan Calculated Property
Pc	1392.29	kPa	Joback Calculated Property
Inp	[2745.00; 2745.00]
Inp	2745.00		NIST
Inp	2745.00		NIST
Tboil	654.33	K	Relay (... Calculated Property
Tc	886.42	K	Relay (... Calculated Property
Tfus	301.45	K	Relay (... Calculated Property
Vc	1.026	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[870.07; 928.05]	J/mol×K	[924.34; 1141.47]
Cp,gas	870.07	J/mol×K	924.34	Joback Calculated Property
Cp,gas	882.63	J/mol×K	960.53	Joback Calculated Property
Cp,gas	894.01	J/mol×K	996.72	Joback Calculated Property
Cp,gas	904.22	J/mol×K	1032.90	Joback Calculated Property
Cp,gas	913.28	J/mol×K	1069.09	Joback Calculated Property
Cp,gas	921.22	J/mol×K	1105.28	Joback Calculated Property
Cp,gas	928.05	J/mol×K	1141.47	Joback Calculated Property
η	[0.0000282; 0.0002723]	Pa×s	[561.66; 924.34]
η	0.0002723	Pa×s	561.66	Joback Calculated Property
η	0.0001553	Pa×s	622.11	Joback Calculated Property
η	0.0000979	Pa×s	682.55	Joback Calculated Property
η	0.0000665	Pa×s	743.00	Joback Calculated Property
η	0.0000478	Pa×s	803.45	Joback Calculated Property
η	0.0000361	Pa×s	863.89	Joback Calculated Property
η	0.0000282	Pa×s	924.34	Joback Calculated Property

Similar Compounds

Find more compounds similar to Fumaric acid, 2-(2-methoxyethyl)hexyl 2,3-dichlorophenyl ester.

Sources

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

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