Chemical Properties of Pyridine, 2,4,6-tris(1,1-dimethylethyl)- (CAS 20336-15-6)

InChI

InChI=1S/C17H29N/c1-15(2,3)12-10-13(16(4,5)6)18-14(11-12)17(7,8)9/h10-11H,1-9H3

InChI Key

IDOFMGSESVXXQI-UHFFFAOYSA-N

Formula

C17H29N

SMILES

CC(C)(C)c1cc(C(C)(C)C)nc(C(C)(C)C)c1

Molecular Weight¹

247.42

CAS

20336-15-6

Other Names

• 2,4,6-Tri(t-butyl)pyridine
• 2,4,6-Tri-tert-butylpyridine
• Pyridine, 2,4,6-tri-tert-butyl-

• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-171.48	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	68.47	kJ/mol	Relay (1.0) Calculated Property
IE	[8.60; 8.60]	eV
IE	8.60	eV	NIST
IE	8.60	eV	NIST
logPoct/wat	4.974		Crippen Calculated Property
McVol	236.610	ml/mol	McGowan Calculated Property
Pc	1612.80	kPa	Relay (1.0-beta) Calculated Property
Tboil	523.67	K	Relay (1.0) Calculated Property
Tc	762.11	K	Relay (1.0) Calculated Property
Tfus	341.00	K	Thermochemical Study of Three Hindered Pyridine Derivatives

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, 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.

Similar Compounds

Find more compounds similar to Pyridine, 2,4,6-tris(1,1-dimethylethyl)-.

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
• Thermochemical Study of Three Hindered Pyridine Derivatives
• 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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