- InChI
- InChI=1S/C13H19NO/c1-2-3-7-10-14-13(15)11-12-8-5-4-6-9-12/h4-6,8-9H,2-3,7,10-11H2,1H3,(H,14,15)
- InChI Key
- YZLZQXXVYJDVEZ-UHFFFAOYSA-N
- Formula
- C13H19NO
- SMILES
- CCCCCN=C(O)Cc1ccccc1
- Molecular Weight1
- 205.30
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -154.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.88 | kJ/mol | Joback Calculated Property |
| log10WS | -3.35 | Crippen Calculated Property | |
| logPoct/wat | 3.376 | Crippen Calculated Property | |
| McVol | 181.820 | ml/mol | McGowan Calculated Property |
| Pc | 2177.49 | kPa | Joback Calculated Property |
| Inp | [1791.00; 1791.00] |
|
|
| Inp | 1791.00 | NIST | |
| Inp | 1791.00 | NIST | |
| Tboil | 692.26 | K | Joback Calculated Property |
| Tc | 894.59 | K | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenylacetamide, N-pentyl-.
Sources
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