Chemical Properties of 4-Methoxycinnamyl cinnamate

InChI

InChI=1S/C19H18O3/c1-21-18-12-9-17(10-13-18)8-5-15-22-19(20)14-11-16-6-3-2-4-7-16/h2-14H,15H2,1H3/b8-5+,14-11+

InChI Key

ZLUKCCCLNLQLQQ-HLSRHWEPSA-N

Formula

C19H18O3

SMILES

COc1ccc(C=CCOC(=O)C=Cc2ccccc2)cc1

Molecular Weight¹

294.34

• 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).
• 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 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	[300.32; 724.91]	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			-4.53490e+01
Coefficient B			1.51352e+00
Coefficient C			-9.67160e-04
Coefficient D			2.23900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	300.32	J/mol×K	273.00	Calculated Property
Cp,gas	378.97	J/mol×K	353.78	Calculated Property
Cp,gas	448.10	J/mol×K	434.56	Calculated Property
Cp,gas	508.41	J/mol×K	515.33	Calculated Property
Cp,gas	560.63	J/mol×K	596.11	Calculated Property
Cp,gas	605.44	J/mol×K	676.89	Calculated Property
Cp,gas	643.57	J/mol×K	757.67	Calculated Property
Cp,gas	675.72	J/mol×K	838.44	Calculated Property
Cp,gas	702.60	J/mol×K	919.22	Calculated Property
Cp,gas	724.91	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007110; 0.0000608]	Pa×s	[423.65; 710.54]	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			-1.33372e+01
Coefficient B			2.57935e+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.			423.65
Temperature range, max.			710.54
η	0.0007110	Pa×s	423.65	Calculated Property
η	0.0004643	Pa×s	455.53	Calculated Property
η	0.0003206	Pa×s	487.40	Calculated Property
η	0.0002317	Pa×s	519.28	Calculated Property
η	0.0001738	Pa×s	551.16	Calculated Property
η	0.0001346	Pa×s	583.04	Calculated Property
η	0.0001070	Pa×s	614.91	Calculated Property
η	0.0000870	Pa×s	646.79	Calculated Property
η	0.0000722	Pa×s	678.67	Calculated Property
η	0.0000608	Pa×s	710.54	Calculated Property

Similar Compounds

Find more compounds similar to 4-Methoxycinnamyl cinnamate.

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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