- InChI
- InChI=1S/C25H49NO/c1-3-5-7-9-11-13-18-22-26(23-19-14-12-10-8-6-4-2)25(27)24-20-16-15-17-21-24/h24H,3-23H2,1-2H3
- InChI Key
- WVJOVNWIYZGUIX-UHFFFAOYSA-N
- Formula
- C25H49NO
- SMILES
-
CCCCCCCCCN(CCCCCCCCC)C(=O)C1CC
CCC1 - Molecular Weight1
- 379.66
- ω : Acentric Factor.
- 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).
- 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 | 0.9944 | Relay (1.0) Calculated Property | |
| ΔfH°gas | -626.71 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 56.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 108.94 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 7.896 | Crippen Calculated Property | |
| McVol | 363.800 | ml/mol | McGowan Calculated Property |
| Pc | 890.00 | kPa | Joback Calculated Property |
| Inp | [2735.00; 2735.00] |
|
|
| Inp | 2735.00 | NIST | |
| Inp | 2735.00 | NIST | |
| Tboil | 656.60 | K | Relay (1.0) Calculated Property |
| Tc | 873.28 | K | Relay (1.0) Calculated Property |
| Tfus | 313.32 | K | Relay (1.0) Calculated Property |
| Vc | 1.368 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Standard Gibbs free energy of formation, 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 | [1231.32; 1347.95] | J/mol×K | [857.46; 1051.33] |
|
| Cp,gas | 1231.32 | J/mol×K | 857.46 | Joback Calculated Property |
| Cp,gas | 1253.91 | J/mol×K | 889.77 | Joback Calculated Property |
| Cp,gas | 1275.15 | J/mol×K | 922.08 | Joback Calculated Property |
| Cp,gas | 1295.11 | J/mol×K | 954.40 | Joback Calculated Property |
| Cp,gas | 1313.85 | J/mol×K | 986.71 | Joback Calculated Property |
| Cp,gas | 1331.44 | J/mol×K | 1019.02 | Joback Calculated Property |
| Cp,gas | 1347.95 | J/mol×K | 1051.33 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexanecarboxamide, N,N-dinonyl-.
Sources
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