- InChI
- InChI=1S/C20H33NO/c1-4-6-8-10-16-21(17-11-9-7-5-2)20(22)19-14-12-18(3)13-15-19/h12-15H,4-11,16-17H2,1-3H3
- InChI Key
- NTIHUNLOTZDVHB-UHFFFAOYSA-N
- Formula
- C20H33NO
- SMILES
-
CCCCCCN(CCCCCC)C(=O)c1ccc(C)cc
1 - Molecular Weight1
- 303.48
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ΔfusH° | 45.83 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.97 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 5.598 | Crippen Calculated Property | |
| McVol | 280.450 | ml/mol | McGowan Calculated Property |
| Inp | [2265.00; 2265.00] |
|
|
| Inp | 2265.00 | NIST | |
| Inp | 2265.00 | NIST | |
| Tboil | 641.45 | K | Relay (1.0) Calculated Property |
| Tfus | 294.06 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, 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 | [837.55; 934.65] | J/mol×K | [755.17; 945.61] |
|
| Cp,gas | 837.55 | J/mol×K | 755.17 | Joback Calculated Property |
| Cp,gas | 856.18 | J/mol×K | 786.91 | Joback Calculated Property |
| Cp,gas | 873.77 | J/mol×K | 818.65 | Joback Calculated Property |
| Cp,gas | 890.36 | J/mol×K | 850.39 | Joback Calculated Property |
| Cp,gas | 906.00 | J/mol×K | 882.13 | Joback Calculated Property |
| Cp,gas | 920.75 | J/mol×K | 913.87 | Joback Calculated Property |
| Cp,gas | 934.65 | J/mol×K | 945.61 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N,N-dihexyl-4-methyl-.
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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