- InChI
- InChI=1S/C8H11N/c1-3-8-4-5-9-7(2)6-8/h4-6H,3H2,1-2H3
- InChI Key
- KNCHDRLWPAKSII-UHFFFAOYSA-N
- Formula
- C8H11N
- SMILES
- CCc1ccnc(C)c1
- Molecular Weight1
- 121.18
- CAS
- 536-88-9
- Other Names
-
- 4-ethyl-2-methylpyridine
- 5-ethyl-2-methylpyridine
- Pyridine, 2-methyl-4-ethyl
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| log10WS | -2.52 | Crippen Calculated Property | |
| logPoct/wat | 1.952 | Crippen Calculated Property | |
| McVol | 109.800 | ml/mol | McGowan Calculated Property |
| Inp | [1026.00; 1043.00] |
|
|
| Inp | 1026.00 | NIST | |
| Inp | 1043.00 | NIST | |
| Inp | 1033.00 | NIST | |
| I | 1440.00 | NIST | |
| Tboil | 453.15 ± 2.00 | K | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.63] | kPa | [336.72; 481.80] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.46565e+01 | |||
| Coefficient B | -3.87777e+03 | |||
| Coefficient C | -6.68480e+01 | |||
| Temperature range, min. | 336.72 | |||
| Temperature range, max. | 481.80 | |||
| Pvap | 1.33 | kPa | 336.72 | Calculated Property |
| Pvap | 3.00 | kPa | 352.84 | Calculated Property |
| Pvap | 6.18 | kPa | 368.96 | Calculated Property |
| Pvap | 11.84 | kPa | 385.08 | Calculated Property |
| Pvap | 21.30 | kPa | 401.20 | Calculated Property |
| Pvap | 36.31 | kPa | 417.32 | Calculated Property |
| Pvap | 59.06 | kPa | 433.44 | Calculated Property |
| Pvap | 92.22 | kPa | 449.56 | Calculated Property |
| Pvap | 138.89 | kPa | 465.68 | Calculated Property |
| Pvap | 202.63 | kPa | 481.80 | Calculated Property |
Similar Compounds
Find more compounds similar to Pyridine, 4-ethyl-2-methyl-.
Sources
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