- 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
-
- Pyridine, 2,4,6-tri-tert-butyl-
- 2,4,6-Tri-tert-butylpyridine
- 2,4,6-Tri(t-butyl)pyridine
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.5327 | Relay (... Calculated Property | |
| ΔfG° | 187.43 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -171.48 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 66.87 | kJ/mol | Relay (... Calculated Property |
| IE | [8.60; 8.60] | eV |
|
| IE | 8.60 | eV | NIST |
| IE | 8.60 | eV | NIST |
| log10WS | -5.48 | Relay (... Calculated Property | |
| logPoct/wat | 4.974 | Crippen Calculated Property | |
| McVol | 236.610 | ml/mol | McGowan Calculated Property |
| Pc | 1620.14 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 523.67 | K | Relay (... Calculated Property |
| Tc | 759.42 | K | Relay (... Calculated Property |
| Tfus | 350.62 | K | Relay (... Calculated Property |
| Vc | 0.920 | m3/kmol | Relay (... Calculated Property |
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
- McGowan Method
- NIST Webbook
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