Chemical Properties of Isobutyl (1-propoxypropan-2-yl) carbonate

InChI

InChI=1S/C11H22O4/c1-5-6-13-8-10(4)15-11(12)14-7-9(2)3/h9-10H,5-8H2,1-4H3

InChI Key

HTQLYHVCGUCEJS-UHFFFAOYSA-N

Formula

C11H22O4

SMILES

CCCOCC(C)OC(=O)OCC(C)C

Molecular Weight¹

218.29

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[285.35; 633.01]	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			6.59340e+01
Coefficient B			8.79480e-01
Coefficient C			-2.64400e-04
Coefficient D			-4.80000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	285.35	J/mol×K	273.00	Calculated Property
Cp,gas	341.86	J/mol×K	353.78	Calculated Property
Cp,gas	394.25	J/mol×K	434.56	Calculated Property
Cp,gas	442.37	J/mol×K	515.33	Calculated Property
Cp,gas	486.08	J/mol×K	596.11	Calculated Property
Cp,gas	525.22	J/mol×K	676.89	Calculated Property
Cp,gas	559.63	J/mol×K	757.67	Calculated Property
Cp,gas	589.17	J/mol×K	838.44	Calculated Property
Cp,gas	613.68	J/mol×K	919.22	Calculated Property
Cp,gas	633.01	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0052321; 0.0001487]	Pa×s	[270.52; 509.02]	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			-1.28522e+01
Coefficient B			2.05574e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			270.52
Temperature range, max.			509.02
η	0.0052321	Pa×s	270.52	Calculated Property
η	0.0026560	Pa×s	297.02	Calculated Property
η	0.0015066	Pa×s	323.52	Calculated Property
η	0.0009313	Pa×s	350.02	Calculated Property
η	0.0006160	Pa×s	376.52	Calculated Property
η	0.0004302	Pa×s	403.02	Calculated Property
η	0.0003140	Pa×s	429.52	Calculated Property
η	0.0002378	Pa×s	456.02	Calculated Property
η	0.0001856	Pa×s	482.52	Calculated Property
η	0.0001487	Pa×s	509.02	Calculated Property

Similar Compounds

Find more compounds similar to Isobutyl (1-propoxypropan-2-yl) carbonate.

Sources

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

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