- InChI
- InChI=1S/C7H12N2/c1-2-3-5-9-6-4-8-7-9/h4,6-7H,2-3,5H2,1H3
- InChI Key
- MCMFEZDRQOJKMN-UHFFFAOYSA-N
- Formula
- C7H12N2
- SMILES
- CCCCn1ccnc1
- Molecular Weight1
- 124.18
- CAS
- 4316-42-1
- Other Names
-
- 1-butyl-1H-imidazole
- 1-n-butylimidazole
- 1H-Imidazole, 1-butyl-
- Butylimidazole
- Imidazole, 1-butyl-
- N-(n-Butyl)imidazole
- N-Butylimidazole
- UN 2690
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- 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 | -2.34 | Crippen Calculated Property | |
| logPoct/wat | 1.683 | Crippen Calculated Property | |
| McVol | 109.990 | ml/mol | McGowan Calculated Property |
| Inp | [1164.00; 1164.00] |
|
|
| Inp | 1164.00 | NIST | |
| Inp | 1164.00 | NIST | |
| I | [1861.00; 1861.00] |
|
|
| I | 1861.00 | NIST | |
| I | 1861.00 | NIST |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔvapH | 63.89 | kJ/mol | 298.15 | Thermoc... |
Similar Compounds
Find more compounds similar to 1-Butylimidazole.
Sources
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