Chemical Properties of L-Sorbitol permethyl

InChI

InChI=1S/C12H26O6/c1-13-7-9(15-3)11(17-5)12(18-6)10(16-4)8-14-2/h9-12H,7-8H2,1-6H3

InChI Key

UJQZVTQJKNAPOQ-UHFFFAOYSA-N

Formula

C12H26O6

SMILES

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

Molecular Weight¹

266.33

• 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

Property	Value	Unit	Source
ΔfusH°	19.87	kJ/mol	Joback Calculated Property
ΔvapH°	75.71	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	0.339		Crippen Calculated Property
McVol	215.160	ml/mol	McGowan Calculated Property
Inp	[1491.00; 1491.00]
Inp	1491.00		NIST
Inp	1491.00		NIST
Tboil	558.87	K	Relay (1.0) Calculated Property

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	[351.21; 751.57]	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			1.38252e+02
Coefficient B			7.88320e-01
Coefficient C			2.42000e-05
Coefficient D			-1.99200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	351.21	J/mol×K	273.00	Calculated Property
Cp,gas	411.35	J/mol×K	353.78	Calculated Property
Cp,gas	469.04	J/mol×K	434.56	Calculated Property
Cp,gas	523.66	J/mol×K	515.33	Calculated Property
Cp,gas	574.58	J/mol×K	596.11	Calculated Property
Cp,gas	621.17	J/mol×K	676.89	Calculated Property
Cp,gas	662.79	J/mol×K	757.67	Calculated Property
Cp,gas	698.81	J/mol×K	838.44	Calculated Property
Cp,gas	728.62	J/mol×K	919.22	Calculated Property
Cp,gas	751.57	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0022252; 0.0000655]	Pa×s	[298.38; 545.17]	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			-1.38972e+01
Coefficient B			2.32418e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			298.38
Temperature range, max.			545.17
η	0.0022252	Pa×s	298.38	Calculated Property
η	0.0011552	Pa×s	325.80	Calculated Property
η	0.0006639	Pa×s	353.22	Calculated Property
η	0.0004133	Pa×s	380.64	Calculated Property
η	0.0002742	Pa×s	408.06	Calculated Property
η	0.0001916	Pa×s	435.49	Calculated Property
η	0.0001396	Pa×s	462.91	Calculated Property
η	0.0001055	Pa×s	490.33	Calculated Property
η	0.0000820	Pa×s	517.75	Calculated Property
η	0.0000655	Pa×s	545.17	Calculated Property

Similar Compounds

Find more compounds similar to L-Sorbitol permethyl.

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.
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