Chemical Properties of 11,12,13-tris-nor-8,8-Dimethyleudesm-5-en-7-one

InChI

InChI=1S/C14H22O/c1-10-6-5-7-14(4)9-13(2,3)12(15)8-11(10)14/h8,10H,5-7,9H2,1-4H3/t10-,14+/m1/s1

InChI Key

FNKVHQVJAQMJDF-IINYFYTJSA-N

Formula

C14H22O

SMILES

C[C@@H]1CCC[C@@]2(C)CC(C)(C)C(=O)C=C12

Molecular Weight¹

206.33

• 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.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate 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	[232.88; 694.30]	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			-1.66340e+02
Coefficient B			1.87078e+00
Coefficient C			-1.67864e-03
Coefficient D			6.68500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	232.88	J/mol×K	273.00	Calculated Property
Cp,gas	315.00	J/mol×K	353.78	Calculated Property
Cp,gas	384.48	J/mol×K	434.56	Calculated Property
Cp,gas	443.43	J/mol×K	515.33	Calculated Property
Cp,gas	493.96	J/mol×K	596.11	Calculated Property
Cp,gas	538.18	J/mol×K	676.89	Calculated Property
Cp,gas	578.21	J/mol×K	757.67	Calculated Property
Cp,gas	616.16	J/mol×K	838.44	Calculated Property
Cp,gas	654.16	J/mol×K	919.22	Calculated Property
Cp,gas	694.30	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 11,12,13-tris-nor-8,8-Dimethyleudesm-5-en-7-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

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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