- InChI
- InChI=1S/C17H33NO/c1-3-4-5-6-7-8-9-12-15-18(2)17(19)16-13-10-11-14-16/h16H,3-15H2,1-2H3
- InChI Key
- XHSTXTFNEHJYRM-UHFFFAOYSA-N
- Formula
- C17H33NO
- SMILES
- CCCCCCCCCCN(C)C(=O)C1CCCC1
- Molecular Weight1
- 267.46
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.7539 | Relay (1.0) Calculated Property | |
| ΔfG° | 110.67 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -451.83 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 38.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.54 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.64 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 4.776 | Crippen Calculated Property | |
| McVol | 251.080 | ml/mol | McGowan Calculated Property |
| Pc | 1469.10 | kPa | Joback Calculated Property |
| Inp | [2026.00; 2026.00] |
|
|
| Inp | 2026.00 | NIST | |
| Inp | 2026.00 | NIST | |
| Tboil | 594.76 | K | Relay (1.0) Calculated Property |
| Tc | 810.08 | K | Relay (1.0) Calculated Property |
| Tfus | 297.15 | K | Relay (1.0) Calculated Property |
| Vc | 0.953 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Log10 of Water solubility in mol/l for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [734.92; 842.87] | J/mol×K | [670.15; 853.21] |
|
| Cp,gas | 734.92 | J/mol×K | 670.15 | Joback Calculated Property |
| Cp,gas | 755.46 | J/mol×K | 700.66 | Joback Calculated Property |
| Cp,gas | 774.91 | J/mol×K | 731.17 | Joback Calculated Property |
| Cp,gas | 793.34 | J/mol×K | 761.68 | Joback Calculated Property |
| Cp,gas | 810.78 | J/mol×K | 792.19 | Joback Calculated Property |
| Cp,gas | 827.27 | J/mol×K | 822.70 | Joback Calculated Property |
| Cp,gas | 842.87 | J/mol×K | 853.21 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopentanecarboxamide, N-decyl-N-methyl-.
Sources
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