Chemical Properties of DIANHYDRODULCITOL

InChI

InChI=1S/C6H10O4/c7-5(3-1-9-3)6(8)4-2-10-4/h3-8H,1-2H2

InChI Key

AAFJXZWCNVJTMK-UHFFFAOYSA-N

Formula

C6H10O4

SMILES

OC(C1CO1)C(O)C1CO1

Molecular Weight¹

146.14

Other Names

• Dianhydrogalactitol
• Dulcitol diepoxide
• DAD
• DAG
• Galactitol, 1,2:5,6-dianhydro-
• NSC 132313
• 1,2:5,6-Dianhydrodulcitol
• 1,2:5,6-Diepoxydulcitol
• 1,2-5,6-Dianhydro-dulcitol

• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• 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, Enthalpy of vaporization 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	[144.97; 365.81]	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			-6.11900e+01
Coefficient B			9.49400e-01
Coefficient C			-7.82400e-04
Coefficient D			2.60000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	144.97	J/mol×K	273.00	Calculated Property
Cp,gas	188.27	J/mol×K	353.78	Calculated Property
Cp,gas	224.97	J/mol×K	434.56	Calculated Property
Cp,gas	255.87	J/mol×K	515.33	Calculated Property
Cp,gas	281.81	J/mol×K	596.11	Calculated Property
Cp,gas	303.60	J/mol×K	676.89	Calculated Property
Cp,gas	322.08	J/mol×K	757.67	Calculated Property
Cp,gas	338.06	J/mol×K	838.44	Calculated Property
Cp,gas	352.36	J/mol×K	919.22	Calculated Property
Cp,gas	365.81	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0252275; 0.0003665]	Pa×s	[338.04; 541.05]	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			-1.49574e+01
Coefficient B			3.81228e+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.			338.04
Temperature range, max.			541.05
η	0.0252275	Pa×s	338.04	Calculated Property
η	0.0124592	Pa×s	360.60	Calculated Property
η	0.0066863	Pa×s	383.15	Calculated Property
η	0.0038453	Pa×s	405.71	Calculated Property
η	0.0023442	Pa×s	428.27	Calculated Property
η	0.0015016	Pa×s	450.83	Calculated Property
η	0.0010036	Pa×s	473.38	Calculated Property
η	0.0006958	Pa×s	495.94	Calculated Property
η	0.0004980	Pa×s	518.50	Calculated Property
η	0.0003665	Pa×s	541.05	Calculated Property

Similar Compounds

Find more compounds similar to DIANHYDRODULCITOL.

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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