Chemical Properties of 7-Norbornadienyl t-butyl ether (CAS 877-06-5)

InChI

InChI=1S/C11H16O/c1-11(2,3)12-10-8-4-5-9(10)7-6-8/h4-10H,1-3H3

InChI Key

PTTSCAGWOHYHDN-UHFFFAOYSA-N

Formula

C11H16O

SMILES

CC(C)(C)OC1C2C=CC1C=C2

Molecular Weight¹

164.24

CAS

877-06-5

Other Names

• 7-tert-Butoxynorbornadiene
• Bicyclo[2.2.1]hepta-2,5-diene, 7-(1,1-dimethylethoxy)-
• 7-Norbornadadienyl t-butyl ether
• 7-tert-butoxybicyclo[2.2.1]hepta-2,5-diene

• 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_boilr : Boiling point at reduced pressure (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, 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.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[190.32; 512.11]	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			-9.01900e+01
Coefficient B			1.26516e+00
Coefficient C			-9.48560e-04
Coefficient D			2.85700e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	190.32	J/mol×K	273.00	Calculated Property
Cp,gas	251.33	J/mol×K	353.78	Calculated Property
Cp,gas	303.91	J/mol×K	434.56	Calculated Property
Cp,gas	348.98	J/mol×K	515.33	Calculated Property
Cp,gas	387.44	J/mol×K	596.11	Calculated Property
Cp,gas	420.18	J/mol×K	676.89	Calculated Property
Cp,gas	448.11	J/mol×K	757.67	Calculated Property
Cp,gas	472.15	J/mol×K	838.44	Calculated Property
Cp,gas	493.18	J/mol×K	919.22	Calculated Property
Cp,gas	512.11	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0012214; 0.0005756]	Pa×s	[268.02; 484.51]	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			-8.39162e+00
Coefficient B			4.51310e+02
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.			268.02
Temperature range, max.			484.51
η	0.0012214	Pa×s	268.02	Calculated Property
η	0.0010632	Pa×s	292.07	Calculated Property
η	0.0009453	Pa×s	316.13	Calculated Property
η	0.0008545	Pa×s	340.18	Calculated Property
η	0.0007829	Pa×s	364.24	Calculated Property
η	0.0007250	Pa×s	388.29	Calculated Property
η	0.0006775	Pa×s	412.35	Calculated Property
η	0.0006378	Pa×s	436.40	Calculated Property
η	0.0006043	Pa×s	460.45	Calculated Property
η	0.0005756	Pa×s	484.51	Calculated Property

Similar Compounds

Find more compounds similar to 7-Norbornadienyl t-butyl ether.

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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