Chemical Properties of Phenol, 2-ethoxy-5-(1-propenyl)- (CAS 94-86-0)

InChI

InChI=1S/C11H14O2/c1-3-5-9-6-7-11(13-4-2)10(12)8-9/h3,5-8,12H,4H2,1-2H3/b5-3+

InChI Key

RADIRXJQODWKGQ-HWKANZROSA-N

Formula

C11H14O2

SMILES

CC=Cc1ccc(OCC)c(O)c1

Molecular Weight¹

178.23

CAS

94-86-0

Other Names

• 1-Ethoxy-2-hydroxy-4-propenylbenzene
• Propenylguaethol
• trans-2-Ethoxy-5-(1-propenyl)phenol
• Hydroxy methyl anethol
• Isosafroeugenol
• Phenol, 2-ethoxy-5-propenyl-
• Vanitrope
• 2-Ethoxy-5-propenylphenol
• 6-Ethoxy-m-anol
• 2-ethoxy-5-prop-1-enylphenol

• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• 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, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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	[202.42; 475.60]	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			-2.43190e+01
Coefficient B			1.02184e+00
Coefficient C			-7.67920e-04
Coefficient D			2.46000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	202.42	J/mol×K	273.00	Calculated Property
Cp,gas	251.97	J/mol×K	353.78	Calculated Property
Cp,gas	294.90	J/mol×K	434.56	Calculated Property
Cp,gas	332.00	J/mol×K	515.33	Calculated Property
Cp,gas	364.04	J/mol×K	596.11	Calculated Property
Cp,gas	391.80	J/mol×K	676.89	Calculated Property
Cp,gas	416.06	J/mol×K	757.67	Calculated Property
Cp,gas	437.59	J/mol×K	838.44	Calculated Property
Cp,gas	457.18	J/mol×K	919.22	Calculated Property
Cp,gas	475.60	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0010233; 0.0000341]	Pa×s	[381.54; 568.99]	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			-1.72099e+01
Coefficient B			3.93947e+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.			381.54
Temperature range, max.			568.99
η	0.0010233	Pa×s	381.54	Calculated Property
η	0.0005996	Pa×s	402.37	Calculated Property
η	0.0003704	Pa×s	423.19	Calculated Property
η	0.0002393	Pa×s	444.02	Calculated Property
η	0.0001608	Pa×s	464.85	Calculated Property
η	0.0001118	Pa×s	485.68	Calculated Property
η	0.0000801	Pa×s	506.50	Calculated Property
η	0.0000589	Pa×s	527.33	Calculated Property
η	0.0000444	Pa×s	548.16	Calculated Property
η	0.0000341	Pa×s	568.99	Calculated Property

Similar Compounds

Find more compounds similar to Phenol, 2-ethoxy-5-(1-propenyl)-.

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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