Chemical Properties of Ether, tert-butyl propenyl, (E)-

InChI

InChI=1S/C7H14O/c1-5-6-8-7(2,3)4/h5-6H,1-4H3

InChI Key

XGCRQUBGQPXCPL-AATRIKPKSA-N

Formula

C7H14O

SMILES

C/C=C/OC(C)(C)C

Molecular Weight¹

114.19

• 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).
• 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, 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	[153.92; 369.85]	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			-1.66300e+01
Coefficient B			7.51480e-01
Coefficient C			-5.01600e-04
Coefficient D			1.36600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	153.92	J/mol×K	273.00	Calculated Property
Cp,gas	192.50	J/mol×K	353.78	Calculated Property
Cp,gas	226.42	J/mol×K	434.56	Calculated Property
Cp,gas	256.12	J/mol×K	515.33	Calculated Property
Cp,gas	282.03	J/mol×K	596.11	Calculated Property
Cp,gas	304.58	J/mol×K	676.89	Calculated Property
Cp,gas	324.21	J/mol×K	757.67	Calculated Property
Cp,gas	341.34	J/mol×K	838.44	Calculated Property
Cp,gas	356.41	J/mol×K	919.22	Calculated Property
Cp,gas	369.85	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0070724; 0.0001821]	Pa×s	[188.22; 397.40]	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			-1.19032e+01
Coefficient B			1.30843e+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.			188.22
Temperature range, max.			397.40
η	0.0070724	Pa×s	188.22	Calculated Property
η	0.0032941	Pa×s	211.46	Calculated Property
η	0.0017850	Pa×s	234.70	Calculated Property
η	0.0010801	Pa×s	257.95	Calculated Property
η	0.0007102	Pa×s	281.19	Calculated Property
η	0.0004979	Pa×s	304.43	Calculated Property
η	0.0003670	Pa×s	327.67	Calculated Property
η	0.0002817	Pa×s	350.92	Calculated Property
η	0.0002235	Pa×s	374.16	Calculated Property
η	0.0001821	Pa×s	397.40	Calculated Property

Similar Compounds

Find more compounds similar to Ether, tert-butyl propenyl, (E)-.

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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