Chemical Properties of 1,3-Dioxolane, 2-(2-phenylethenyl), (Z)

InChI

InChI=1S/C11H12O2/c1-2-4-10(5-3-1)6-7-11-12-8-9-13-11/h1-7,11H,8-9H2/b7-6-

InChI Key

JQLASNFFJHGQTK-SREVYHEPSA-N

Formula

C11H12O2

SMILES

C(=CC1OCCO1)c1ccccc1

Molecular Weight¹

176.21

• 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).
• 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_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, Standard Gibbs free energy of formation, Acentric Factor, 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	[169.07; 460.06]	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			-8.10400e+01
Coefficient B			1.11560e+00
Coefficient C			-7.89200e-04
Coefficient D			2.14700e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	169.07	J/mol×K	273.00	Calculated Property
Cp,gas	224.37	J/mol×K	353.78	Calculated Property
Cp,gas	272.34	J/mol×K	434.56	Calculated Property
Cp,gas	313.66	J/mol×K	515.33	Calculated Property
Cp,gas	349.02	J/mol×K	596.11	Calculated Property
Cp,gas	379.09	J/mol×K	676.89	Calculated Property
Cp,gas	404.55	J/mol×K	757.67	Calculated Property
Cp,gas	426.08	J/mol×K	838.44	Calculated Property
Cp,gas	444.36	J/mol×K	919.22	Calculated Property
Cp,gas	460.06	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0036566; 0.0002570]	Pa×s	[299.11; 555.60]	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			-1.13633e+01
Coefficient B			1.72050e+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.			299.11
Temperature range, max.			555.60
η	0.0036566	Pa×s	299.11	Calculated Property
η	0.0022170	Pa×s	327.61	Calculated Property
η	0.0014563	Pa×s	356.11	Calculated Property
η	0.0010180	Pa×s	384.61	Calculated Property
η	0.0007477	Pa×s	413.10	Calculated Property
η	0.0005715	Pa×s	441.60	Calculated Property
η	0.0004513	Pa×s	470.10	Calculated Property
η	0.0003661	Pa×s	498.60	Calculated Property
η	0.0003038	Pa×s	527.10	Calculated Property
η	0.0002570	Pa×s	555.60	Calculated Property

Similar Compounds

Find more compounds similar to 1,3-Dioxolane, 2-(2-phenylethenyl), (Z).

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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