Chemical Properties of trans-2,5-Diisopropyl-1,3-dioxane (CAS 25925-01-3)

InChI

InChI=1S/C10H20O2/c1-7(2)9-5-11-10(8(3)4)12-6-9/h7-10H,5-6H2,1-4H3/t9-,10-

InChI Key

YAISJNQHUBKIPN-MGCOHNPYSA-N

Formula

C10H20O2

SMILES

CC(C)C1COC(C(C)C)OC1

Molecular Weight¹

172.26

CAS

25925-01-3

• Δ_cH°_liquid : Standard liquid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
• 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).
• 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, 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	[215.86; 567.09]	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			-3.45900e+01
Coefficient B			1.05528e+00
Coefficient C			-5.24400e-04
Coefficient D			7.08000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	215.86	J/mol×K	273.00	Calculated Property
Cp,gas	276.25	J/mol×K	353.78	Calculated Property
Cp,gas	330.77	J/mol×K	434.56	Calculated Property
Cp,gas	379.66	J/mol×K	515.33	Calculated Property
Cp,gas	423.13	J/mol×K	596.11	Calculated Property
Cp,gas	461.41	J/mol×K	676.89	Calculated Property
Cp,gas	494.72	J/mol×K	757.67	Calculated Property
Cp,gas	523.29	J/mol×K	838.44	Calculated Property
Cp,gas	547.34	J/mol×K	919.22	Calculated Property
Cp,gas	567.09	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0134801; 0.0002818]	Pa×s	[228.74; 490.44]	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			-1.15549e+01
Coefficient B			1.65800e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			228.74
Temperature range, max.			490.44
η	0.0134801	Pa×s	228.74	Calculated Property
η	0.0059519	Pa×s	257.82	Calculated Property
η	0.0031016	Pa×s	286.89	Calculated Property
η	0.0018223	Pa×s	315.97	Calculated Property
η	0.0011711	Pa×s	345.05	Calculated Property
η	0.0008061	Pa×s	374.13	Calculated Property
η	0.0005856	Pa×s	403.20	Calculated Property
η	0.0004441	Pa×s	432.28	Calculated Property
η	0.0003487	Pa×s	461.36	Calculated Property
η	0.0002818	Pa×s	490.44	Calculated Property

Similar Compounds

Find more compounds similar to trans-2,5-Diisopropyl-1,3-dioxane.

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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