Chemical Properties of 2-isobutoxy-3,4-dihydro-2H-pyran

InChI

InChI=1S/C9H16O2/c1-8(2)7-11-9-5-3-4-6-10-9/h4,6,8-9H,3,5,7H2,1-2H3

InChI Key

WGSGJOWWPBIGTI-UHFFFAOYSA-N

Formula

C9H16O2

SMILES

CC(C)COC1CCC=CO1

Molecular Weight¹

156.22

• 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).
• 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, 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	[184.26; 475.98]	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			-2.19790e+01
Coefficient B			8.64640e-01
Coefficient C			-4.12380e-04
Coefficient D			4.57000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	184.26	J/mol×K	273.00	Calculated Property
Cp,gas	234.32	J/mol×K	353.78	Calculated Property
Cp,gas	279.63	J/mol×K	434.56	Calculated Property
Cp,gas	320.34	J/mol×K	515.33	Calculated Property
Cp,gas	356.58	J/mol×K	596.11	Calculated Property
Cp,gas	388.52	J/mol×K	676.89	Calculated Property
Cp,gas	416.28	J/mol×K	757.67	Calculated Property
Cp,gas	440.01	J/mol×K	838.44	Calculated Property
Cp,gas	459.86	J/mol×K	919.22	Calculated Property
Cp,gas	475.98	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0071498; 0.0002316]	Pa×s	[233.13; 474.10]	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			-1.16887e+01
Coefficient B			1.57317e+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.			233.13
Temperature range, max.			474.10
η	0.0071498	Pa×s	233.13	Calculated Property
η	0.0035677	Pa×s	259.90	Calculated Property
η	0.0020271	Pa×s	286.68	Calculated Property
η	0.0012685	Pa×s	313.45	Calculated Property
η	0.0008546	Pa×s	340.23	Calculated Property
η	0.0006099	Pa×s	367.00	Calculated Property
η	0.0004557	Pa×s	393.78	Calculated Property
η	0.0003534	Pa×s	420.55	Calculated Property
η	0.0002825	Pa×s	447.33	Calculated Property
η	0.0002316	Pa×s	474.10	Calculated Property

Similar Compounds

Find more compounds similar to 2-isobutoxy-3,4-dihydro-2H-pyran.

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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