Chemical Properties of As-Indacene, 1,2,3,6,7,8-hexahydro-1,1,6,6-tetramethyl-4-(1-methylethyl)- (CAS 17465-47-3)

InChI

InChI=1S/C19H28/c1-12(2)15-11-16-14(8-9-18(16,3)4)17-13(15)7-10-19(17,5)6/h11-12H,7-10H2,1-6H3

InChI Key

BDVXGLCBHPSEGG-UHFFFAOYSA-N

Formula

C19H28

SMILES

CC(C)c1cc2c(c3c1CCC3(C)C)CCC2(C)C

Molecular Weight¹

256.43

CAS

17465-47-3

Other Names

• As-Hydrindacene, 4-isopropyl-1,1,6,6-tetramethyl-

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, 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	[306.43; 843.54]	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			-1.93240e+02
Coefficient B			2.38352e+00
Coefficient C			-2.28164e-03
Coefficient D			9.34900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	306.43	J/mol×K	273.00	Calculated Property
Cp,gas	405.83	J/mol×K	353.78	Calculated Property
Cp,gas	488.39	J/mol×K	434.56	Calculated Property
Cp,gas	557.08	J/mol×K	515.33	Calculated Property
Cp,gas	614.86	J/mol×K	596.11	Calculated Property
Cp,gas	664.69	J/mol×K	676.89	Calculated Property
Cp,gas	709.51	J/mol×K	757.67	Calculated Property
Cp,gas	752.29	J/mol×K	838.44	Calculated Property
Cp,gas	795.98	J/mol×K	919.22	Calculated Property
Cp,gas	843.54	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to As-Indacene, 1,2,3,6,7,8-hexahydro-1,1,6,6-tetramethyl-4-(1-methylethyl)-.

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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