Chemical Properties of cis-Eudesm-4(15)-en-1-one

InChI

InChI=1S/C15H24O/c1-10(2)12-7-8-15(4)13(9-12)11(3)5-6-14(15)16/h10,12-13H,3,5-9H2,1-2,4H3/t12?,13?,15-/m1/s1

InChI Key

VFGDFTMUULURTA-SSDMNJCBSA-N

Formula

C15H24O

SMILES

C=C1CCC(=O)C2(C)CCC(C(C)C)CC12

Molecular Weight¹

220.35

• 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.
• 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[258.13; 741.53]	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			-1.18730e+02
Coefficient B			1.67776e+00
Coefficient C			-1.19100e-03
Coefficient D			3.73500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	258.13	J/mol×K	273.00	Calculated Property
Cp,gas	342.30	J/mol×K	353.78	Calculated Property
Cp,gas	416.09	J/mol×K	434.56	Calculated Property
Cp,gas	480.70	J/mol×K	515.33	Calculated Property
Cp,gas	537.30	J/mol×K	596.11	Calculated Property
Cp,gas	587.07	J/mol×K	676.89	Calculated Property
Cp,gas	631.20	J/mol×K	757.67	Calculated Property
Cp,gas	670.87	J/mol×K	838.44	Calculated Property
Cp,gas	707.25	J/mol×K	919.22	Calculated Property
Cp,gas	741.53	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to cis-Eudesm-4(15)-en-1-one.

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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