Chemical Properties of 4-Methoxy-4'-dodecoxy-trans-stilbene

InChI

InChI=1S/C27H38O2/c1-3-4-5-6-7-8-9-10-11-12-23-29-27-21-17-25(18-22-27)14-13-24-15-19-26(28-2)20-16-24/h13-22H,3-12,23H2,1-2H3/b14-13+

InChI Key

ZTKXXACFPFBWBM-BUHFOSPRSA-N

Formula

C27H38O2

SMILES

CCCCCCCCCCCCOc1ccc(/C=C/c2ccc(OC)cc2)cc1

Molecular Weight¹

394.60

• 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_fusH : Enthalpy of fusion at a given temperature (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).
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• 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 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.

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[485.65; 1175.57]	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			-2.40490e+01
Coefficient B			2.18564e+00
Coefficient C			-1.23512e-03
Coefficient D			2.49100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	485.65	J/mol×K	273.00	Calculated Property
Cp,gas	605.63	J/mol×K	353.78	Calculated Property
Cp,gas	712.94	J/mol×K	434.56	Calculated Property
Cp,gas	808.37	J/mol×K	515.33	Calculated Property
Cp,gas	892.70	J/mol×K	596.11	Calculated Property
Cp,gas	966.74	J/mol×K	676.89	Calculated Property
Cp,gas	1031.25	J/mol×K	757.67	Calculated Property
Cp,gas	1087.04	J/mol×K	838.44	Calculated Property
Cp,gas	1134.88	J/mol×K	919.22	Calculated Property
Cp,gas	1175.57	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0011640; 0.0000342]	Pa×s	[415.00; 800.77]	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			-1.40751e+01
Coefficient B			3.03750e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			415.00
Temperature range, max.			800.77
η	0.0011640	Pa×s	415.00	Calculated Property
η	0.0005867	Pa×s	457.86	Calculated Property
η	0.0003325	Pa×s	500.73	Calculated Property
η	0.0002061	Pa×s	543.59	Calculated Property
η	0.0001370	Pa×s	586.45	Calculated Property
η	0.0000963	Pa×s	629.32	Calculated Property
η	0.0000708	Pa×s	672.18	Calculated Property
η	0.0000540	Pa×s	715.05	Calculated Property
η	0.0000424	Pa×s	757.91	Calculated Property
η	0.0000342	Pa×s	800.77	Calculated Property

Similar Compounds

Find more compounds similar to 4-Methoxy-4'-dodecoxy-trans-stilbene.

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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