Chemical Properties of 5-Ethoxy-2-hydroxy-m-xylene-alpha1,alpha3-diol

InChI

InChI=1S/C10H14O4/c1-2-14-9-3-7(5-11)10(13)8(4-9)6-12/h3-4,11-13H,2,5-6H2,1H3

InChI Key

NBFKYLZEXFDQTQ-UHFFFAOYSA-N

Formula

C10H14O4

SMILES

CCOc1cc(CO)c(O)c(CO)c1

Molecular Weight¹

198.22

Other Names

• 5-Ethoxy-2-hydroxy-m-xylene-alpha

• 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).
• IE : Ionization energy (eV).
• 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, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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	[222.76; 488.89]	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			1.56530e+01
Coefficient B			9.15320e-01
Coefficient C			-6.23480e-04
Coefficient D			1.81400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	222.76	J/mol×K	273.00	Calculated Property
Cp,gas	269.47	J/mol×K	353.78	Calculated Property
Cp,gas	310.56	J/mol×K	434.56	Calculated Property
Cp,gas	346.60	J/mol×K	515.33	Calculated Property
Cp,gas	378.16	J/mol×K	596.11	Calculated Property
Cp,gas	405.82	J/mol×K	676.89	Calculated Property
Cp,gas	430.15	J/mol×K	757.67	Calculated Property
Cp,gas	451.72	J/mol×K	838.44	Calculated Property
Cp,gas	471.11	J/mol×K	919.22	Calculated Property
Cp,gas	488.89	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0000708; 0.0000026]	Pa×s	[509.51; 662.88]	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			-2.37986e+01
Coefficient B			7.25699e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			509.51
Temperature range, max.			662.88
η	0.0000708	Pa×s	509.51	Calculated Property
η	0.0000447	Pa×s	526.55	Calculated Property
η	0.0000290	Pa×s	543.59	Calculated Property
η	0.0000193	Pa×s	560.63	Calculated Property
η	0.0000132	Pa×s	577.67	Calculated Property
η	0.0000092	Pa×s	594.72	Calculated Property
η	0.0000065	Pa×s	611.76	Calculated Property
η	0.0000047	Pa×s	628.80	Calculated Property
η	0.0000035	Pa×s	645.84	Calculated Property
η	0.0000026	Pa×s	662.88	Calculated Property

Similar Compounds

Find more compounds similar to 5-Ethoxy-2-hydroxy-m-xylene-alpha1,alpha3-diol.

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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