Chemical Properties of Cedranoxide, 8,14-

InChI

InChI=1S/C15H24O/c1-10-4-5-11-13(2)9-16-14(3)6-7-15(10,11)8-12(13)14/h10-12H,4-9H2,1-3H3

InChI Key

WHMSWWROVUQISG-UHFFFAOYSA-N

Formula

C15H24O

SMILES

CC1CCC2C3(C)COC4(C)CCC12CC43

Molecular Weight¹

220.36

Other Names

• 8,14-Cedrane oxide
• 8,14-Cedranoxide

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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.
• I : 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°	16.27	kJ/mol	Joback Calculated Property
logPoct/wat	3.628		Crippen Calculated Property
McVol	184.640	ml/mol	McGowan Calculated Property
Inp	[1539.00; 1552.40]
Inp	1546.00		NIST
Inp	1544.00		NIST
Inp	1552.40		NIST
Inp	1539.00		NIST
Inp	1546.00		NIST
Inp	1539.00		NIST
Inp	1552.40		NIST
I	[1858.00; 1877.00]
I	1858.00		NIST
I	1858.00		NIST
I	1877.00		NIST
Tfus	337.79	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, 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	[235.13; 768.75]	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			-3.37610e+02
Coefficient B			2.84256e+00
Coefficient C			-3.09970e-03
Coefficient D			1.36350e-06
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	235.13	J/mol×K	273.00	Calculated Property
Cp,gas	340.44	J/mol×K	353.78	Calculated Property
Cp,gas	424.19	J/mol×K	434.56	Calculated Property
Cp,gas	490.68	J/mol×K	515.33	Calculated Property
Cp,gas	544.22	J/mol×K	596.11	Calculated Property
Cp,gas	589.14	J/mol×K	676.89	Calculated Property
Cp,gas	629.74	J/mol×K	757.67	Calculated Property
Cp,gas	670.33	J/mol×K	838.44	Calculated Property
Cp,gas	715.23	J/mol×K	919.22	Calculated Property
Cp,gas	768.75	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Cedranoxide, 8,14-.

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.
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