Chemical Properties of Acetic acid, 2-(3,5-dimethoxyphenyl)-, methyl ester

InChI

InChI=1S/C11H14O4/c1-13-9-4-8(6-11(12)15-3)5-10(7-9)14-2/h4-5,7H,6H2,1-3H3

InChI Key

CLZWNNSTRIEAMH-UHFFFAOYSA-N

Formula

C11H14O4

SMILES

COC(=O)Cc1cc(OC)cc(OC)c1

Molecular Weight¹

210.23

Other Names

• Methyl 3,5-dimethoxyphenylacetate

• 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).
• 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).
• 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 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	[233.82; 507.33]	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			6.39910e+01
Coefficient B			6.69760e-01
Coefficient C			-1.55120e-04
Coefficient D			-7.13000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	233.82	J/mol×K	273.00	Calculated Property
Cp,gas	278.37	J/mol×K	353.78	Calculated Property
Cp,gas	319.90	J/mol×K	434.56	Calculated Property
Cp,gas	358.19	J/mol×K	515.33	Calculated Property
Cp,gas	393.02	J/mol×K	596.11	Calculated Property
Cp,gas	424.16	J/mol×K	676.89	Calculated Property
Cp,gas	451.39	J/mol×K	757.67	Calculated Property
Cp,gas	474.47	J/mol×K	838.44	Calculated Property
Cp,gas	493.20	J/mol×K	919.22	Calculated Property
Cp,gas	507.33	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0010194; 0.0001382]	Pa×s	[351.98; 556.95]	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			-1.23178e+01
Coefficient B			1.91100e+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.			351.98
Temperature range, max.			556.95
η	0.0010194	Pa×s	351.98	Calculated Property
η	0.0007329	Pa×s	374.75	Calculated Property
η	0.0005472	Pa×s	397.53	Calculated Property
η	0.0004218	Pa×s	420.30	Calculated Property
η	0.0003339	Pa×s	443.08	Calculated Property
η	0.0002704	Pa×s	465.85	Calculated Property
η	0.0002233	Pa×s	488.63	Calculated Property
η	0.0001876	Pa×s	511.40	Calculated Property
η	0.0001600	Pa×s	534.18	Calculated Property
η	0.0001382	Pa×s	556.95	Calculated Property

Similar Compounds

Find more compounds similar to Acetic acid, 2-(3,5-dimethoxyphenyl)-, methyl ester.

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

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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.