Chemical Properties of Diethylmalonic acid, decyl 2,4-dichloro-6-formylphenyl ester

InChI

InChI=1S/C24H34Cl2O5/c1-4-7-8-9-10-11-12-13-14-30-22(28)24(5-2,6-3)23(29)31-21-18(17-27)15-19(25)16-20(21)26/h15-17H,4-14H2,1-3H3

InChI Key

ITWLWHQVUHDWPK-UHFFFAOYSA-N

Formula

C24H34Cl2O5

SMILES

CCCCCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1c(Cl)cc(Cl)cc1C=O

Molecular Weight¹

473.43

• 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	1.1012		Relay (1.0) Calculated Property
ΔfG°	-353.66	kJ/mol	Joback Calculated Property
ΔfH°gas	-1027.48	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	59.63	kJ/mol	Joback Calculated Property
ΔvapH°	121.96	kJ/mol	Relay (1.0) Calculated Property
IE	8.96	eV	Relay (1.0) Calculated Property
log10WS	-7.13		Relay (1.0) Calculated Property
logPoct/wat	7.202		Crippen Calculated Property
McVol	366.190	ml/mol	McGowan Calculated Property
Pc	1024.00	kPa	Joback Calculated Property
Inp	[2999.00; 2999.00]
Inp	2999.00		NIST
Inp	2999.00		NIST
Tboil	664.90	K	Relay (1.0) Calculated Property
Tc	938.15	K	Relay (1.0) Calculated Property
Tfus	322.77	K	Relay (1.0) Calculated Property
Vc	1.315	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1176.81; 1233.10]	J/mol×K	[1063.01; 1301.86]
Cp,gas	1176.81	J/mol×K	1063.01	Joback Calculated Property
Cp,gas	1189.48	J/mol×K	1102.82	Joback Calculated Property
Cp,gas	1200.75	J/mol×K	1142.63	Joback Calculated Property
Cp,gas	1210.67	J/mol×K	1182.43	Joback Calculated Property
Cp,gas	1219.32	J/mol×K	1222.24	Joback Calculated Property
Cp,gas	1226.78	J/mol×K	1262.05	Joback Calculated Property
Cp,gas	1233.10	J/mol×K	1301.86	Joback Calculated Property
η	[0.0000180; 0.0001568]	Pa×s	[672.80; 1063.01]
η	0.0001568	Pa×s	672.80	Joback Calculated Property
η	0.0000933	Pa×s	737.84	Joback Calculated Property
η	0.0000604	Pa×s	802.87	Joback Calculated Property
η	0.0000417	Pa×s	867.90	Joback Calculated Property
η	0.0000303	Pa×s	932.94	Joback Calculated Property
η	0.0000230	Pa×s	997.97	Joback Calculated Property
η	0.0000180	Pa×s	1063.01	Joback Calculated Property

Similar Compounds

Find more compounds similar to Diethylmalonic acid, decyl 2,4-dichloro-6-formylphenyl ester.

Sources

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

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