- InChI
- InChI=1S/C8H11N/c1-6-4-8(3)9-5-7(6)2/h4-5H,1-3H3
- InChI Key
- MNDSSKADVGDFDF-UHFFFAOYSA-N
- Formula
- C8H11N
- SMILES
- Cc1cc(C)c(C)cn1
- Molecular Weight1
- 121.18
- CAS
- 1122-39-0
- Other Names
-
- Pyridine, 2,4,5-trimethyl-
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- 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 | -2.66 | Crippen Calculated Property | |
| logPoct/wat | 2.007 | Crippen Calculated Property | |
| McVol | 109.800 | ml/mol | McGowan Calculated Property |
| Inp | [1053.90; 1084.00] |
|
|
| Inp | 1066.00 | NIST | |
| Inp | 1084.00 | NIST | |
| Inp | 1053.90 | NIST | |
| Inp | 1071.00 | NIST | |
| I | [1507.00; 1507.00] |
|
|
| I | 1507.00 | NIST | |
| I | 1507.00 | NIST | |
| Tboil | 456.65 ± 5.00 | K | NIST |
Similar Compounds
Find more compounds similar to 2,4,5-Trimethylpyridine.
Sources
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