- InChI
- InChI=1S/C30H53NO/c1-4-6-8-10-12-14-16-18-20-26-31(30(32)29-24-22-28(3)23-25-29)27-21-19-17-15-13-11-9-7-5-2/h22-25H,4-21,26-27H2,1-3H3
- InChI Key
- NAXZIGNVXWOYPO-UHFFFAOYSA-N
- Formula
- C30H53NO
- SMILES
-
CCCCCCCCCCCN(CCCCCCCCCCC)C(=O)
c1ccc(C)cc1 - Molecular Weight1
- 443.75
- 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° | 71.73 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 132.50 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.30 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 9.499 | Crippen Calculated Property | |
| McVol | 421.350 | ml/mol | McGowan Calculated Property |
| Inp | [3507.00; 3507.00] |
|
|
| Inp | 3507.00 | NIST | |
| Inp | 3507.00 | NIST | |
| Tboil | 707.73 | K | Relay (1.0) Calculated Property |
| Tfus | 318.14 | 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 | [1462.73; 1578.33] | J/mol×K | [983.97; 1208.99] |
|
| Cp,gas | 1462.73 | J/mol×K | 983.97 | Joback Calculated Property |
| Cp,gas | 1485.24 | J/mol×K | 1021.47 | Joback Calculated Property |
| Cp,gas | 1506.30 | J/mol×K | 1058.98 | Joback Calculated Property |
| Cp,gas | 1526.02 | J/mol×K | 1096.48 | Joback Calculated Property |
| Cp,gas | 1544.52 | J/mol×K | 1133.98 | Joback Calculated Property |
| Cp,gas | 1561.92 | J/mol×K | 1171.48 | Joback Calculated Property |
| Cp,gas | 1578.33 | J/mol×K | 1208.99 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N,N-diundecyl-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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