Chemical Properties of 2,4,5-TRIETHOXYBENZOPHENONE

InChI

InChI=1S/C19H22O4/c1-4-21-16-13-18(23-6-3)17(22-5-2)12-15(16)19(20)14-10-8-7-9-11-14/h7-13H,4-6H2,1-3H3

InChI Key

ATJSQHQJQSASKB-UHFFFAOYSA-N

Formula

C19H22O4

SMILES

CCOc1cc(OCC)c(C(=O)c2ccccc2)cc1OCC

Molecular Weight¹

314.38

Other Names

• Methanone, phenyl(2,4,5-triethoxyphenyl)-

• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[348.82; 797.90]	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			4.45630e+01
Coefficient B			1.25496e+00
Coefficient C			-5.19380e-04
Coefficient D			1.77600e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	348.82	J/mol×K	273.00	Calculated Property
Cp,gas	424.32	J/mol×K	353.78	Calculated Property
Cp,gas	493.29	J/mol×K	434.56	Calculated Property
Cp,gas	555.79	J/mol×K	515.33	Calculated Property
Cp,gas	611.86	J/mol×K	596.11	Calculated Property
Cp,gas	661.57	J/mol×K	676.89	Calculated Property
Cp,gas	704.97	J/mol×K	757.67	Calculated Property
Cp,gas	742.13	J/mol×K	838.44	Calculated Property
Cp,gas	773.08	J/mol×K	919.22	Calculated Property
Cp,gas	797.90	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0003600; 0.0000768]	Pa×s	[510.91; 730.66]	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			-1.30674e+01
Coefficient B			2.62500e+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.			510.91
Temperature range, max.			730.66
η	0.0003600	Pa×s	510.91	Calculated Property
η	0.0002848	Pa×s	535.33	Calculated Property
η	0.0002299	Pa×s	559.74	Calculated Property
η	0.0001890	Pa×s	584.16	Calculated Property
η	0.0001578	Pa×s	608.58	Calculated Property
η	0.0001336	Pa×s	632.99	Calculated Property
η	0.0001146	Pa×s	657.41	Calculated Property
η	0.0000993	Pa×s	681.83	Calculated Property
η	0.0000869	Pa×s	706.24	Calculated Property
η	0.0000768	Pa×s	730.66	Calculated Property

Similar Compounds

Find more compounds similar to 2,4,5-TRIETHOXYBENZOPHENONE.

Sources

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

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