- InChI
- InChI=1S/C15H15NO2/c1-18-14-9-7-13(8-10-14)16-15(17)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,16,17)
- InChI Key
- LZSPYXRRVCVACQ-UHFFFAOYSA-N
- Formula
- C15H15NO2
- SMILES
- COc1ccc(NC(=O)Cc2ccccc2)cc1
- Molecular Weight1
- 241.29
- 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).
- Inp : Non-polar retention indices.
- 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° | 146.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -82.67 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.79 | kJ/mol | Joback Calculated Property |
| log10WS | -3.41 | Crippen Calculated Property | |
| logPoct/wat | 2.876 | Crippen Calculated Property | |
| McVol | 192.110 | ml/mol | McGowan Calculated Property |
| Pc | 2624.46 | kPa | Joback Calculated Property |
| Inp | [2224.00; 2224.00] |
|
|
| Inp | 2224.00 | NIST | |
| Inp | 2224.00 | NIST | |
| Tboil | 727.40 | K | Joback Calculated Property |
| Tc | 963.37 | K | Joback Calculated Property |
| Tfus | 448.99 | K | Joback Calculated Property |
| Vc | 0.719 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [517.85; 589.66] | J/mol×K | [727.40; 963.37] |
|
| Cp,gas | 517.85 | J/mol×K | 727.40 | Joback Calculated Property |
| Cp,gas | 532.62 | J/mol×K | 766.73 | Joback Calculated Property |
| Cp,gas | 546.20 | J/mol×K | 806.06 | Joback Calculated Property |
| Cp,gas | 558.64 | J/mol×K | 845.39 | Joback Calculated Property |
| Cp,gas | 570.00 | J/mol×K | 884.72 | Joback Calculated Property |
| Cp,gas | 580.32 | J/mol×K | 924.05 | Joback Calculated Property |
| Cp,gas | 589.66 | J/mol×K | 963.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Acetamide, N-(4-methoxyphenyl)-2-phenyl-.
Sources
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