- InChI
- InChI=1S/C6H9N/c1-2-6-3-4-7-5-6/h3-5,7H,2H2,1H3
- InChI Key
- RLLBWIDEGAIFPI-UHFFFAOYSA-N
- Formula
- C6H9N
- SMILES
- CCc1cc[nH]c1
- Molecular Weight1
- 95.14
- CAS
- 1551-16-2
- Other Names
-
- 3-ethyl-1H-pyrrole
- 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.
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| log10WS | -1.49 | Crippen Calculated Property | |
| logPoct/wat | 1.095 | Crippen Calculated Property | |
| McVol | 85.920 | ml/mol | McGowan Calculated Property |
| Inp | [950.00; 950.00] |
|
|
| Inp | 950.00 | NIST | |
| Inp | 950.00 | NIST | |
| I | [1617.00; 1657.00] |
|
|
| I | 1617.00 | NIST | |
| I | 1657.00 | NIST |
Similar Compounds
Find more compounds similar to 1H-Pyrrole, 3-ethyl-.
Sources
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