Chemical Properties of Diethylmalonic acid, monochloride, decyl ester

InChI

InChI=1S/C17H31ClO3/c1-4-7-8-9-10-11-12-13-14-21-16(20)17(5-2,6-3)15(18)19/h4-14H2,1-3H3

InChI Key

KSWCHIVJMVRMIO-UHFFFAOYSA-N

Formula

C17H31ClO3

SMILES

CCCCCCCCCCOC(=O)C(CC)(CC)C(=O)Cl

Molecular Weight¹

318.88

• 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	0.8064		Relay (... Calculated Property
ΔfG°	-279.67	kJ/mol	Joback Calculated Property
ΔfH°gas	-829.04	kJ/mol	Relay (... Calculated Property
ΔfusH°	40.95	kJ/mol	Joback Calculated Property
ΔvapH°	83.45	kJ/mol	Relay (... Calculated Property
IE	9.36	eV	Relay (... Calculated Property
log10WS	-5.49		Relay (... Calculated Property
logPoct/wat	5.242		Crippen Calculated Property
McVol	271.640	ml/mol	McGowan Calculated Property
Pc	1313.70	kPa	Joback Calculated Property
Inp	[1928.00; 1928.00]
Inp	1928.00		NIST
Inp	1928.00		NIST
Tboil	572.87	K	Relay (... Calculated Property
Tc	771.18	K	Relay (... Calculated Property
Tfus	293.15	K	Relay (... Calculated Property
Vc	0.988	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[794.32; 880.47]	J/mol×K	[752.72; 938.73]
Cp,gas	794.32	J/mol×K	752.72	Joback Calculated Property
Cp,gas	810.85	J/mol×K	783.72	Joback Calculated Property
Cp,gas	826.46	J/mol×K	814.72	Joback Calculated Property
Cp,gas	841.19	J/mol×K	845.73	Joback Calculated Property
Cp,gas	855.08	J/mol×K	876.73	Joback Calculated Property
Cp,gas	868.16	J/mol×K	907.73	Joback Calculated Property
Cp,gas	880.47	J/mol×K	938.73	Joback Calculated Property
η	[0.0000768; 0.0013130]	Pa×s	[435.78; 752.72]
η	0.0013130	Pa×s	435.78	Joback Calculated Property
η	0.0006336	Pa×s	488.60	Joback Calculated Property
η	0.0003524	Pa×s	541.43	Joback Calculated Property
η	0.0002176	Pa×s	594.25	Joback Calculated Property
η	0.0001453	Pa×s	647.07	Joback Calculated Property
η	0.0001032	Pa×s	699.90	Joback Calculated Property
η	0.0000768	Pa×s	752.72	Joback Calculated Property

Similar Compounds

Find more compounds similar to Diethylmalonic acid, monochloride, decyl ester.

Sources

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

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