Chemical Properties of Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)- (CAS 2226-05-3)

InChI

InChI=1S/C11H18O/c1-11(2)9-4-3-8(7-9)10(11)5-6-12/h5,8-9,12H,3-4,6-7H2,1-2H3/b10-5+

InChI Key

JGDHOHFQJJATNG-BJMVGYQFSA-N

Formula

C11H18O

SMILES

CC1(C)C(=CCO)C2CCC1C2

Molecular Weight¹

166.26

CAS

2226-05-3

Other Names

• 2,2-Dimethyl-1-norbornylideneethanol
• 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)ethanol
• 8-Camphenemethanol
• Patchenol
• «delta»(2,«beta»)-Norbornaneethanol, 3,3-dimethyl-

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• IE : Ionization energy (eV).
• 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).
• 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, Standard Gibbs free energy of formation, Acentric Factor, 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	[190.21; 546.76]	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			-1.40379e+02
Coefficient B			1.56294e+00
Coefficient C			-1.44470e-03
Coefficient D			5.68900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	190.21	J/mol×K	273.00	Calculated Property
Cp,gas	256.93	J/mol×K	353.78	Calculated Property
Cp,gas	312.67	J/mol×K	434.56	Calculated Property
Cp,gas	359.25	J/mol×K	515.33	Calculated Property
Cp,gas	398.44	J/mol×K	596.11	Calculated Property
Cp,gas	432.06	J/mol×K	676.89	Calculated Property
Cp,gas	461.91	J/mol×K	757.67	Calculated Property
Cp,gas	489.77	J/mol×K	838.44	Calculated Property
Cp,gas	517.46	J/mol×K	919.22	Calculated Property
Cp,gas	546.76	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-.

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.