Chemical Properties of 2,2,4a,6a,6b,9-Hexamethyl-1,2,3,4,4 a,5,6,6a,6b,7,8,12b,13,14b-tetradecahydro-picene

InChI

InChI=1S/C28H40/c1-19-8-7-9-21-20(19)12-13-27(5)22(21)10-11-23-24-18-25(2,3)14-15-26(24,4)16-17-28(23,27)6/h7-9,11,22,24H,10,12-18H2,1-6H3

InChI Key

LLJZJNHOOHQEGE-UHFFFAOYSA-N

Formula

C28H40

SMILES

Cc1cccc2c1CCC1(C)C2CC=C2C3CC(C)(C)CCC3(C)CCC21C

Molecular Weight¹

376.63

• 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1193.22; 1491.54]	J/mol×K	[916.48; 1172.05]
Cp,gas	1193.22	J/mol×K	916.48	Joback Calculated Property
Cp,gas	1232.78	J/mol×K	959.07	Joback Calculated Property
Cp,gas	1275.36	J/mol×K	1001.67	Joback Calculated Property
Cp,gas	1321.75	J/mol×K	1044.26	Joback Calculated Property
Cp,gas	1372.72	J/mol×K	1086.86	Joback Calculated Property
Cp,gas	1429.05	J/mol×K	1129.45	Joback Calculated Property
Cp,gas	1491.54	J/mol×K	1172.05	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,2,4a,6a,6b,9-Hexamethyl-1,2,3,4,4 a,5,6,6a,6b,7,8,12b,13,14b-tetradecahydro-picene.

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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