Chemical Properties of fucitol, acetylated

InChI

InChI=1S/C16H24O10/c1-8(23-10(3)18)15(25-12(5)20)16(26-13(6)21)14(24-11(4)19)7-22-9(2)17/h8,14-16H,7H2,1-6H3/t8-,14+,15+,16-/m1/s1

InChI Key

CZLGYDMUTMQWDY-PAQICSSTSA-N

Formula

C16H24O10

SMILES

CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(C)OC(C)=O

Molecular Weight¹

376.36

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• 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).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[425.33; 887.48]	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			1.08661e+02
Coefficient B			1.27352e+00
Coefficient C			-3.86400e-04
Coefficient D			-1.08300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	425.33	J/mol×K	273.00	Calculated Property
Cp,gas	506.05	J/mol×K	353.78	Calculated Property
Cp,gas	580.22	J/mol×K	434.56	Calculated Property
Cp,gas	647.51	J/mol×K	515.33	Calculated Property
Cp,gas	707.57	J/mol×K	596.11	Calculated Property
Cp,gas	760.06	J/mol×K	676.89	Calculated Property
Cp,gas	804.64	J/mol×K	757.67	Calculated Property
Cp,gas	840.97	J/mol×K	838.44	Calculated Property
Cp,gas	868.69	J/mol×K	919.22	Calculated Property
Cp,gas	887.48	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0013895; 0.0000260]	Pa×s	[421.73; 737.55]	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			-1.58665e+01
Coefficient B			3.91688e+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.			421.73
Temperature range, max.			737.55
η	0.0013895	Pa×s	421.73	Calculated Property
η	0.0006808	Pa×s	456.82	Calculated Property
η	0.0003693	Pa×s	491.91	Calculated Property
η	0.0002173	Pa×s	527.00	Calculated Property
η	0.0001367	Pa×s	562.09	Calculated Property
η	0.0000907	Pa×s	597.18	Calculated Property
η	0.0000631	Pa×s	632.28	Calculated Property
η	0.0000455	Pa×s	667.37	Calculated Property
η	0.0000340	Pa×s	702.46	Calculated Property
η	0.0000260	Pa×s	737.55	Calculated Property

Similar Compounds

Find more compounds similar to fucitol, acetylated.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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