- InChI
- InChI=1S/C15H23NO/c1-4-16(12-13(2)3)15(17)11-10-14-8-6-5-7-9-14/h5-9,13H,4,10-12H2,1-3H3
- InChI Key
- LEOSSYMCQYJDIB-UHFFFAOYSA-N
- Formula
- C15H23NO
- SMILES
- CCN(CC(C)C)C(=O)CCc1ccccc1
- Molecular Weight1
- 233.35
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion 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).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | 167.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -166.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.74 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.66 | kJ/mol | Joback Calculated Property |
| log10WS | -3.31 | Crippen Calculated Property | |
| logPoct/wat | 3.124 | Crippen Calculated Property | |
| McVol | 210.000 | ml/mol | McGowan Calculated Property |
| Pc | 1961.34 | kPa | Joback Calculated Property |
| Tboil | 635.15 | K | Joback Calculated Property |
| Tc | 835.55 | K | Joback Calculated Property |
| Tfus | 352.63 | K | Joback Calculated Property |
| Vc | 0.785 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [557.61; 649.43] | J/mol×K | [635.15; 835.55] | 
|
| Cp,gas | 557.61 | J/mol×K | 635.15 | Joback Calculated Property |
| Cp,gas | 575.42 | J/mol×K | 668.55 | Joback Calculated Property |
| Cp,gas | 592.16 | J/mol×K | 701.95 | Joback Calculated Property |
| Cp,gas | 607.88 | J/mol×K | 735.35 | Joback Calculated Property |
| Cp,gas | 622.63 | J/mol×K | 768.75 | Joback Calculated Property |
| Cp,gas | 636.46 | J/mol×K | 802.15 | Joback Calculated Property |
| Cp,gas | 649.43 | J/mol×K | 835.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, 3-phenyl-N-ethyl-N-isobutyl-.
Sources
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