- InChI
- InChI=1S/C8H11N/c1-3-8-4-5-9-6-7(8)2/h4-6H,3H2,1-2H3
- InChI Key
- NJQZTGGQYUUYKS-UHFFFAOYSA-N
- Formula
- C8H11N
- SMILES
- CCc1ccncc1C
- Molecular Weight1
- 121.18
- CAS
- 20815-29-6
- Other Names
-
- Pyridine, 4-ethyl-3-methyl-
- 4-ethyl-3-methylpyridine
- 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).
- Inp : Non-polar retention indices.
- 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 | 0.3590 | Relay (... Calculated Property | |
| ΔfG° | 181.12 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | 48.08 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 51.10 | kJ/mol | Relay (... Calculated Property |
| IE | 9.29 | eV | Relay (... Calculated Property |
| log10WS | -0.83 | Relay (... Calculated Property | |
| logPoct/wat | 1.952 | Crippen Calculated Property | |
| McVol | 109.800 | ml/mol | McGowan Calculated Property |
| Pc | 3585.92 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | 1104.00 | NIST | |
| Tboil | 461.92 | K | Relay (... Calculated Property |
| Tc | 677.17 | K | Relay (... Calculated Property |
| Tfus | 228.47 | K | Relay (... Calculated Property |
| Vc | 0.398 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 3-Picoline, 4-ethyl-.
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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