- InChI
- InChI=1S/C19H39NO/c1-6-8-10-12-14-16-20(18(21)19(3,4)5)17-15-13-11-9-7-2/h6-17H2,1-5H3
- InChI Key
- WMFVDRIGDVTEIA-UHFFFAOYSA-N
- Formula
- C19H39NO
- SMILES
- CCCCCCCN(CCCCCCC)C(=O)C(C)(C)C
- Molecular Weight1
- 297.53
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -550.56 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 42.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.44 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 5.802 | Crippen Calculated Property | |
| McVol | 290.120 | ml/mol | McGowan Calculated Property |
| Inp | 2009.00 | NIST | |
| Tboil | 574.47 | K | Relay (1.0) Calculated Property |
| Tfus | 252.70 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [860.49; 966.59] | J/mol×K | [697.40; 870.09] | 
|
| Cp,gas | 860.49 | J/mol×K | 697.40 | Joback Calculated Property |
| Cp,gas | 880.46 | J/mol×K | 726.18 | Joback Calculated Property |
| Cp,gas | 899.46 | J/mol×K | 754.96 | Joback Calculated Property |
| Cp,gas | 917.52 | J/mol×K | 783.74 | Joback Calculated Property |
| Cp,gas | 934.70 | J/mol×K | 812.52 | Joback Calculated Property |
| Cp,gas | 951.04 | J/mol×K | 841.31 | Joback Calculated Property |
| Cp,gas | 966.59 | J/mol×K | 870.09 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, N,N-diheptyl-2,2-dimethyl-.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
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