- InChI
- InChI=1S/C18H29NO/c1-4-6-8-11-16(3)19(5-2)18(20)15-14-17-12-9-7-10-13-17/h7,9-10,12-13,16H,4-6,8,11,14-15H2,1-3H3
- InChI Key
- SNUPGCCRORSLOI-UHFFFAOYSA-N
- Formula
- C18H29NO
- SMILES
- CCCCCC(C)N(CC)C(=O)CCc1ccccc1
- Molecular Weight1
- 275.43
- 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° | 192.51 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -228.65 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.51 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.34 | kJ/mol | Joback Calculated Property |
| log10WS | -4.92 | Crippen Calculated Property | |
| logPoct/wat | 4.437 | Crippen Calculated Property | |
| McVol | 252.270 | ml/mol | McGowan Calculated Property |
| Pc | 1542.71 | kPa | Joback Calculated Property |
| Inp | [2166.00; 2166.00] |
|
|
| Inp | 2166.00 | NIST | |
| Inp | 2166.00 | NIST | |
| Tboil | 703.79 | K | Joback Calculated Property |
| Tc | 897.76 | K | Joback Calculated Property |
| Tfus | 386.44 | K | Joback Calculated Property |
| Vc | 0.954 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [722.51; 818.86] | J/mol×K | [703.79; 897.76] |
|
| Cp,gas | 722.51 | J/mol×K | 703.79 | Joback Calculated Property |
| Cp,gas | 741.10 | J/mol×K | 736.12 | Joback Calculated Property |
| Cp,gas | 758.61 | J/mol×K | 768.45 | Joback Calculated Property |
| Cp,gas | 775.09 | J/mol×K | 800.78 | Joback Calculated Property |
| Cp,gas | 790.59 | J/mol×K | 833.11 | Joback Calculated Property |
| Cp,gas | 805.16 | J/mol×K | 865.43 | Joback Calculated Property |
| Cp,gas | 818.86 | J/mol×K | 897.76 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, 3-phenyl-N-ethyl-N-hept-2-yl-.
Sources
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