Chemical Properties of Adonitol, pentamethyl ether

InChI

InChI=1S/C10H22O5/c1-11-6-8(13-3)10(15-5)9(14-4)7-12-2/h8-10H,6-7H2,1-5H3

InChI Key

UKACKIRJWDAFEZ-UHFFFAOYSA-N

Formula

C10H22O5

SMILES

COCC(OC)C(OC)C(COC)OC

Molecular Weight¹

222.28

• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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	[293.70; 629.35]	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			1.16252e+02
Coefficient B			6.55600e-01
Coefficient C			2.52000e-05
Coefficient D			-1.67700e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	293.70	J/mol×K	273.00	Calculated Property
Cp,gas	343.92	J/mol×K	353.78	Calculated Property
Cp,gas	392.14	J/mol×K	434.56	Calculated Property
Cp,gas	437.85	J/mol×K	515.33	Calculated Property
Cp,gas	480.49	J/mol×K	596.11	Calculated Property
Cp,gas	519.56	J/mol×K	676.89	Calculated Property
Cp,gas	554.50	J/mol×K	757.67	Calculated Property
Cp,gas	584.81	J/mol×K	838.44	Calculated Property
Cp,gas	609.93	J/mol×K	919.22	Calculated Property
Cp,gas	629.35	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0030159; 0.0001023]	Pa×s	[268.61; 497.45]	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			-1.31601e+01
Coefficient B			1.97595e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			268.61
Temperature range, max.			497.45
η	0.0030159	Pa×s	268.61	Calculated Property
η	0.0015965	Pa×s	294.04	Calculated Property
η	0.0009351	Pa×s	319.46	Calculated Property
η	0.0005927	Pa×s	344.89	Calculated Property
η	0.0003999	Pa×s	370.32	Calculated Property
η	0.0002839	Pa×s	395.74	Calculated Property
η	0.0002100	Pa×s	421.17	Calculated Property
η	0.0001608	Pa×s	446.59	Calculated Property
η	0.0001267	Pa×s	472.02	Calculated Property
η	0.0001023	Pa×s	497.45	Calculated Property

Similar Compounds

Find more compounds similar to Adonitol, pentamethyl ether.

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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