Chemical Properties of (4-(2'-Propenyl)phenyl)phenyl ether

InChI

InChI=1S/C15H14O2/c1-2-12-16-13-8-10-15(11-9-13)17-14-6-4-3-5-7-14/h2-11H,1,12H2

InChI Key

NAYOLUZVOCYYFZ-UHFFFAOYSA-N

Formula

C15H14O2

SMILES

C=CCOc1ccc(Oc2ccccc2)cc1

Molecular Weight¹

226.27

• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.5786		Relay (1.0) Calculated Property
ΔfH°gas	-29.12	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	23.39	kJ/mol	Joback Calculated Property
ΔvapH°	80.42	kJ/mol	Relay (1.0) Calculated Property
IE	7.89	eV	Relay (1.0) Calculated Property
log10WS	-4.48		Relay (1.0) Calculated Property
logPoct/wat	4.044		Crippen Calculated Property
McVol	182.130	ml/mol	McGowan Calculated Property
Pc	2492.52	kPa	Joback Calculated Property
Inp	[1744.00; 1744.00]
Inp	1744.00		NIST
Inp	1744.00		NIST
Tboil	610.61	K	Relay (1.0) Calculated Property
Tc	827.05	K	Relay (1.0) Calculated Property
Tfus	295.31	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation 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	[232.73; 561.59]	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			-1.62490e+01
Coefficient B			1.06510e+00
Coefficient C			-5.88460e-04
Coefficient D			1.01200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	232.73	J/mol×K	273.00	Calculated Property
Cp,gas	291.39	J/mol×K	353.78	Calculated Property
Cp,gas	343.78	J/mol×K	434.56	Calculated Property
Cp,gas	390.21	J/mol×K	515.33	Calculated Property
Cp,gas	431.00	J/mol×K	596.11	Calculated Property
Cp,gas	466.47	J/mol×K	676.89	Calculated Property
Cp,gas	496.95	J/mol×K	757.67	Calculated Property
Cp,gas	522.75	J/mol×K	838.44	Calculated Property
Cp,gas	544.19	J/mol×K	919.22	Calculated Property
Cp,gas	561.59	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0010202; 0.0001248]	Pa×s	[366.87; 613.54]	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			-1.21142e+01
Coefficient B			1.91744e+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.			366.87
Temperature range, max.			613.54
η	0.0010202	Pa×s	366.87	Calculated Property
η	0.0007094	Pa×s	394.28	Calculated Property
η	0.0005172	Pa×s	421.68	Calculated Property
η	0.0003918	Pa×s	449.09	Calculated Property
η	0.0003065	Pa×s	476.50	Calculated Property
η	0.0002463	Pa×s	503.91	Calculated Property
η	0.0002024	Pa×s	531.31	Calculated Property
η	0.0001695	Pa×s	558.72	Calculated Property
η	0.0001444	Pa×s	586.13	Calculated Property
η	0.0001248	Pa×s	613.54	Calculated Property

Similar Compounds

Find more compounds similar to (4-(2'-Propenyl)phenyl)phenyl ether.

Sources

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

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