Chemical Properties of 2,3-Dehydro-1,4-cineol

InChI

InChI=1S/C10H16O/c1-8(2)10-6-4-9(3,11-10)5-7-10/h4,6,8H,5,7H2,1-3H3

InChI Key

KSMRNKXOGJCMES-UHFFFAOYSA-N

Formula

C10H16O

SMILES

CC(C)C12C=CC(C)(CC1)O2

Molecular Weight¹

152.23

Other Names

• p-Menth-2-ene, 1,4-epoxy

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion 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_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	8.91	kJ/mol	Joback Calculated Property
IE	8.74	eV	Relay (1.0) Calculated Property
logPoct/wat	2.520		Crippen Calculated Property
McVol	131.610	ml/mol	McGowan Calculated Property
Inp	[1220.00; 1220.00]
Inp	1220.00		NIST
Inp	1220.00		NIST
Tfus	224.46	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, 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, 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	[168.56; 499.91]	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			-1.88370e+02
Coefficient B			1.77676e+00
Coefficient C			-1.95598e-03
Coefficient D			8.67500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	168.56	J/mol×K	273.00	Calculated Property
Cp,gas	233.81	J/mol×K	353.78	Calculated Property
Cp,gas	285.55	J/mol×K	434.56	Calculated Property
Cp,gas	326.53	J/mol×K	515.33	Calculated Property
Cp,gas	359.48	J/mol×K	596.11	Calculated Property
Cp,gas	387.15	J/mol×K	676.89	Calculated Property
Cp,gas	412.29	J/mol×K	757.67	Calculated Property
Cp,gas	437.63	J/mol×K	838.44	Calculated Property
Cp,gas	465.92	J/mol×K	919.22	Calculated Property
Cp,gas	499.91	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 2,3-Dehydro-1,4-cineol.

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.
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