Chemical Properties of Ethylene glycol mono-2,2,4-trimethyl-3-oxovalerate

InChI

InChI=1S/C10H18O4/c1-7(2)8(12)10(3,4)9(13)14-6-5-11/h7,11H,5-6H2,1-4H3

InChI Key

NARNUWZBBOTQQX-UHFFFAOYSA-N

Formula

C10H18O4

SMILES

CC(C)C(=O)C(C)(C)C(=O)OCCO

Molecular Weight¹

202.25

• 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).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[245.61; 553.04]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			5.70200e+00
Coefficient B			1.03678e+00
Coefficient C			-6.12300e-04
Coefficient D			1.22860e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	245.61	J/mol×K	273.00	Calculated Property
Cp,gas	301.30	J/mol×K	353.78	Calculated Property
Cp,gas	350.70	J/mol×K	434.56	Calculated Property
Cp,gas	394.20	J/mol×K	515.33	Calculated Property
Cp,gas	432.18	J/mol×K	596.11	Calculated Property
Cp,gas	465.05	J/mol×K	676.89	Calculated Property
Cp,gas	493.18	J/mol×K	757.67	Calculated Property
Cp,gas	516.96	J/mol×K	838.44	Calculated Property
Cp,gas	536.79	J/mol×K	919.22	Calculated Property
Cp,gas	553.04	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0089597; 0.0001003]	Pa×s	[342.96; 568.29]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.60455e+01
Coefficient B			3.88590e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			342.96
Temperature range, max.			568.29
η	0.0089597	Pa×s	342.96	Calculated Property
η	0.0041449	Pa×s	368.00	Calculated Property
η	0.0021153	Pa×s	393.03	Calculated Property
η	0.0011701	Pa×s	418.07	Calculated Property
η	0.0006921	Pa×s	443.11	Calculated Property
η	0.0004330	Pa×s	468.14	Calculated Property
η	0.0002841	Pa×s	493.18	Calculated Property
η	0.0001941	Pa×s	518.22	Calculated Property
η	0.0001374	Pa×s	543.25	Calculated Property
η	0.0001003	Pa×s	568.29	Calculated Property

Similar Compounds

Find more compounds similar to Ethylene glycol mono-2,2,4-trimethyl-3-oxovalerate.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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