Chemical Properties of 3,4-Diethoxybenzaldehyde

InChI

InChI=1S/C11H14O3/c1-3-13-10-6-5-9(8-12)7-11(10)14-4-2/h5-8H,3-4H2,1-2H3

InChI Key

SSTRYEXQYQGGAS-UHFFFAOYSA-N

Formula

C11H14O3

SMILES

CCOc1ccc(C=O)cc1OCC

Molecular Weight¹

194.23

Other Names

• Benzaldehyde, 3,4-diethoxy-

• 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).
• Δ_vapH° : Enthalpy of vaporization 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, 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	[222.40; 490.00]	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			4.99820e+01
Coefficient B			6.99040e-01
Coefficient C			-2.42720e-04
Coefficient D			-1.63000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	222.40	J/mol×K	273.00	Calculated Property
Cp,gas	266.19	J/mol×K	353.78	Calculated Property
Cp,gas	306.58	J/mol×K	434.56	Calculated Property
Cp,gas	343.53	J/mol×K	515.33	Calculated Property
Cp,gas	376.98	J/mol×K	596.11	Calculated Property
Cp,gas	406.89	J/mol×K	676.89	Calculated Property
Cp,gas	433.20	J/mol×K	757.67	Calculated Property
Cp,gas	455.85	J/mol×K	838.44	Calculated Property
Cp,gas	474.80	J/mol×K	919.22	Calculated Property
Cp,gas	490.00	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0011708; 0.0002017]	Pa×s	[351.65; 550.14]	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			-1.16240e+01
Coefficient B			1.71391e+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.			351.65
Temperature range, max.			550.14
η	0.0011708	Pa×s	351.65	Calculated Property
η	0.0008782	Pa×s	373.70	Calculated Property
η	0.0006801	Pa×s	395.76	Calculated Property
η	0.0005411	Pa×s	417.81	Calculated Property
η	0.0004405	Pa×s	439.87	Calculated Property
η	0.0003657	Pa×s	461.92	Calculated Property
η	0.0003089	Pa×s	483.98	Calculated Property
η	0.0002647	Pa×s	506.03	Calculated Property
η	0.0002298	Pa×s	528.09	Calculated Property
η	0.0002017	Pa×s	550.14	Calculated Property

Similar Compounds

Find more compounds similar to 3,4-Diethoxybenzaldehyde.

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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