Chemical Properties of Ethanone, 2-ethoxy-1,2-diphenyl- (CAS 574-09-4)

InChI

InChI=1S/C16H16O2/c1-2-18-16(14-11-7-4-8-12-14)15(17)13-9-5-3-6-10-13/h3-12,16H,2H2,1H3

InChI Key

KMNCBSZOIQAUFX-UHFFFAOYSA-N

Formula

C16H16O2

SMILES

CCOC(C(=O)c1ccccc1)c1ccccc1

Molecular Weight¹

240.30

CAS

574-09-4

Other Names

• Acetophenone, 2-ethoxy-2-phenyl-
• Benzoin ethyl ether
• Ethyl benzoin ether
• 2-Ethoxy-2-phenylacetophenone
• 2-Ethoxybenzoin
• 2-Ethoxy-1,2-diphenylethanone
• 2-ethoxy-1,2-diphenylethan-1-one

• 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

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	[246.40; 615.79]	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			-4.82890e+01
Coefficient B			1.28072e+00
Coefficient C			-7.82500e-04
Coefficient D			1.65860e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	246.40	J/mol×K	273.00	Calculated Property
Cp,gas	314.21	J/mol×K	353.78	Calculated Property
Cp,gas	374.10	J/mol×K	434.56	Calculated Property
Cp,gas	426.60	J/mol×K	515.33	Calculated Property
Cp,gas	472.24	J/mol×K	596.11	Calculated Property
Cp,gas	511.53	J/mol×K	676.89	Calculated Property
Cp,gas	545.01	J/mol×K	757.67	Calculated Property
Cp,gas	573.20	J/mol×K	838.44	Calculated Property
Cp,gas	596.61	J/mol×K	919.22	Calculated Property
Cp,gas	615.79	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0017325; 0.0001398]	Pa×s	[380.08; 652.79]	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			-1.23831e+01
Coefficient B			2.28994e+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.			380.08
Temperature range, max.			652.79
η	0.0017325	Pa×s	380.08	Calculated Property
η	0.0011104	Pa×s	410.38	Calculated Property
η	0.0007565	Pa×s	440.68	Calculated Property
η	0.0005416	Pa×s	470.98	Calculated Property
η	0.0004036	Pa×s	501.29	Calculated Property
η	0.0003111	Pa×s	531.59	Calculated Property
η	0.0002466	Pa×s	561.89	Calculated Property
η	0.0002002	Pa×s	592.19	Calculated Property
η	0.0001658	Pa×s	622.49	Calculated Property
η	0.0001398	Pa×s	652.79	Calculated Property

Similar Compounds

Find more compounds similar to Ethanone, 2-ethoxy-1,2-diphenyl-.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.