Chemical Properties of Ethyl (Z)-hex-3-enyl carbonate

InChI

InChI=1S/C9H16O3/c1-3-5-6-7-8-12-9(10)11-4-2/h5-6H,3-4,7-8H2,1-2H3/b6-5-

InChI Key

QVGDVJSCRGIGEX-WAYWQWQTSA-N

Formula

C9H16O3

SMILES

CCC=CCCOC(=O)OCC

Molecular Weight¹

172.22

• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Pressure, Critical Volume, 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	[214.14; 479.67]	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			3.14340e+01
Coefficient B			7.60840e-01
Coefficient C			-3.44000e-04
Coefficient D			3.14000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	214.14	J/mol×K	273.00	Calculated Property
Cp,gas	258.94	J/mol×K	353.78	Calculated Property
Cp,gas	299.68	J/mol×K	434.56	Calculated Property
Cp,gas	336.46	J/mol×K	515.33	Calculated Property
Cp,gas	369.39	J/mol×K	596.11	Calculated Property
Cp,gas	398.56	J/mol×K	676.89	Calculated Property
Cp,gas	424.08	J/mol×K	757.67	Calculated Property
Cp,gas	446.04	J/mol×K	838.44	Calculated Property
Cp,gas	464.53	J/mol×K	919.22	Calculated Property
Cp,gas	479.67	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0038600; 0.0001834]	Pa×s	[250.67; 467.70]	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			-1.21232e+01
Coefficient B			1.64593e+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.			250.67
Temperature range, max.			467.70
η	0.0038600	Pa×s	250.67	Calculated Property
η	0.0021694	Pa×s	274.78	Calculated Property
η	0.0013381	Pa×s	298.90	Calculated Property
η	0.0008870	Pa×s	323.01	Calculated Property
η	0.0006226	Pa×s	347.13	Calculated Property
η	0.0004576	Pa×s	371.24	Calculated Property
η	0.0003491	Pa×s	395.35	Calculated Property
η	0.0002748	Pa×s	419.47	Calculated Property
η	0.0002220	Pa×s	443.58	Calculated Property
η	0.0001834	Pa×s	467.70	Calculated Property

Similar Compounds

Find more compounds similar to Ethyl (Z)-hex-3-enyl carbonate.

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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