- InChI
- InChI=1S/C22H43NO/c1-5-9-13-19(7-3)17-23(18-20(8-4)14-10-6-2)22(24)21-15-11-12-16-21/h19-21H,5-18H2,1-4H3
- InChI Key
- ITYCDYBYLCSIDA-UHFFFAOYSA-N
- Formula
- C22H43NO
- SMILES
-
CCCCC(CC)CN(CC(CC)CCCC)C(=O)C1
CCCC1 - Molecular Weight1
- 337.58
- 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° | 147.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -492.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.84 | kJ/mol | Joback Calculated Property |
| log10WS | -6.55 | Crippen Calculated Property | |
| logPoct/wat | 6.438 | Crippen Calculated Property | |
| McVol | 321.530 | ml/mol | McGowan Calculated Property |
| Pc | 1058.95 | kPa | Joback Calculated Property |
| Inp | [2151.00; 2151.00] |
|
|
| Inp | 2151.00 | NIST | |
| Inp | 2151.00 | NIST | |
| Tboil | 783.47 | K | Joback Calculated Property |
| Tc | 970.41 | K | Joback Calculated Property |
| Tfus | 401.00 | K | Joback Calculated Property |
| Vc | 1.220 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1036.65; 1151.02] | J/mol×K | [783.47; 970.41] |
|
| Cp,gas | 1036.65 | J/mol×K | 783.47 | Joback Calculated Property |
| Cp,gas | 1058.55 | J/mol×K | 814.63 | Joback Calculated Property |
| Cp,gas | 1079.24 | J/mol×K | 845.78 | Joback Calculated Property |
| Cp,gas | 1098.78 | J/mol×K | 876.94 | Joback Calculated Property |
| Cp,gas | 1117.21 | J/mol×K | 908.10 | Joback Calculated Property |
| Cp,gas | 1134.61 | J/mol×K | 939.25 | Joback Calculated Property |
| Cp,gas | 1151.02 | J/mol×K | 970.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopentanecarboxamide, N,N-bis(2-ethylhexyl)-.
Sources
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