Chemical Properties of Triethyl methanetricarboxylate (CAS 6279-86-3)

InChI

InChI=1S/C10H16O6/c1-4-14-8(11)7(9(12)15-5-2)10(13)16-6-3/h7H,4-6H2,1-3H3

InChI Key

AGZPNUZBDCYTBB-UHFFFAOYSA-N

Formula

C10H16O6

SMILES

CCOC(=O)C(C(=O)OCC)C(=O)OCC

Molecular Weight¹

232.23

CAS

6279-86-3

Other Names

• Diethyl 2-(ethoxycarbonyl)malonate
• Tricarbethoxymethane
• Methanetricarboxylic acid, triethyl ester

• ω : Acentric Factor.
• Δ_cH°_liquid : Standard liquid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,liquid : Liquid phase 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_fH°_liquid : Liquid phase 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• 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	0.6417		Relay (1.0) Calculated Property
ΔcH°liquid	-4969.46 ± 0.67	kJ/mol	NIST
ΔfG°	-900.23	kJ/mol	Joback Calculated Property
ΔfH°gas	-1173.10 ± 1.30	kJ/mol	NIST
ΔfH°liquid	-1252.30 ± 1.00	kJ/mol	NIST
ΔfusH°	31.24	kJ/mol	Joback Calculated Property
ΔvapH°	[79.10; 79.20]	kJ/mol
ΔvapH°	79.20 ± 0.71	kJ/mol	NIST
ΔvapH°	79.20	kJ/mol	NIST
ΔvapH°	79.10 ± 0.70	kJ/mol	NIST
IE	9.74	eV	Relay (1.0) Calculated Property
log10WS	-1.87		Relay (1.0) Calculated Property
logPoct/wat	0.292		Crippen Calculated Property
McVol	174.080	ml/mol	McGowan Calculated Property
Pc	2153.30	kPa	Joback Calculated Property
Tboil	526.20	K	NIST
Tc	702.52	K	Relay (1.0) Calculated Property
Tfus	227.87	K	Relay (1.0) Calculated Property
Vc	0.648	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[446.63; 514.25]	J/mol×K	[602.62; 785.51]
Cp,gas	446.63	J/mol×K	602.62	Joback Calculated Property
Cp,gas	459.61	J/mol×K	633.10	Joback Calculated Property
Cp,gas	471.92	J/mol×K	663.58	Joback Calculated Property
Cp,gas	483.56	J/mol×K	694.07	Joback Calculated Property
Cp,gas	494.49	J/mol×K	724.55	Joback Calculated Property
Cp,gas	504.73	J/mol×K	755.03	Joback Calculated Property
Cp,gas	514.25	J/mol×K	785.51	Joback Calculated Property
Cp,liquid	419.80	J/mol×K	298.15	NIST
η	[0.0001074; 0.0045202]	Pa×s	[314.45; 602.62]
η	0.0045202	Pa×s	314.45	Joback Calculated Property
η	0.0016038	Pa×s	362.48	Joback Calculated Property
η	0.0007252	Pa×s	410.51	Joback Calculated Property
η	0.0003872	Pa×s	458.53	Joback Calculated Property
η	0.0002329	Pa×s	506.56	Joback Calculated Property
η	0.0001530	Pa×s	554.59	Joback Calculated Property
η	0.0001074	Pa×s	602.62	Joback Calculated Property
ΔvapH	74.10 ± 0.40	kJ/mol	318.00	NIST

Similar Compounds

Find more compounds similar to Triethyl methanetricarboxylate.

Sources

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

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