Chemical Properties of 3-Buten-2-ol, 4-phenyl- (CAS 17488-65-2)

InChI

InChI=1S/C10H12O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-9,11H,1H3/b8-7+

InChI Key

ZIJWGEHOVHJHKB-BQYQJAHWSA-N

Formula

C10H12O

SMILES

CC(O)C=Cc1ccccc1

Molecular Weight¹

148.20

CAS

17488-65-2

Other Names

• «alpha»-Methyl-«gamma»-phenylallyl alcohol
• 1-Methyl-3-phenylallyl alcohol
• 4-Phenyl-3-buten-2-ol
• «alpha»-Methyl-3-phenylallyl alcohol

• 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	[158.55; 405.34]	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			-5.06800e+01
Coefficient B			9.34820e-01
Coefficient C			-6.68800e-04
Coefficient D			1.90000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	158.55	J/mol×K	273.00	Calculated Property
Cp,gas	204.75	J/mol×K	353.78	Calculated Property
Cp,gas	244.85	J/mol×K	434.56	Calculated Property
Cp,gas	279.45	J/mol×K	515.33	Calculated Property
Cp,gas	309.17	J/mol×K	596.11	Calculated Property
Cp,gas	334.59	J/mol×K	676.89	Calculated Property
Cp,gas	356.31	J/mol×K	757.67	Calculated Property
Cp,gas	374.94	J/mol×K	838.44	Calculated Property
Cp,gas	391.09	J/mol×K	919.22	Calculated Property
Cp,gas	405.34	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0253050; 0.0001041]	Pa×s	[269.62; 529.27]	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			-1.48744e+01
Coefficient B			3.01911e+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.			269.62
Temperature range, max.			529.27
η	0.0253050	Pa×s	269.62	Calculated Property
η	0.0085733	Pa×s	298.47	Calculated Property
η	0.0035152	Pa×s	327.32	Calculated Property
η	0.0016652	Pa×s	356.17	Calculated Property
η	0.0008823	Pa×s	385.02	Calculated Property
η	0.0005108	Pa×s	413.87	Calculated Property
η	0.0003175	Pa×s	442.72	Calculated Property
η	0.0002092	Pa×s	471.57	Calculated Property
η	0.0001446	Pa×s	500.42	Calculated Property
η	0.0001041	Pa×s	529.27	Calculated Property

Similar Compounds

Find more compounds similar to 3-Buten-2-ol, 4-phenyl-.

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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