- InChI
- InChI=1S/C23H45NO/c1-5-9-14-20(7-3)18-24(19-21(8-4)15-10-6-2)23(25)22-16-12-11-13-17-22/h20-22H,5-19H2,1-4H3
- InChI Key
- LZMUWQUKBWZZGG-UHFFFAOYSA-N
- Formula
- C23H45NO
- SMILES
-
CCCCC(CC)CN(CC(CC)CCCC)C(=O)C1
CCCCC1 - Molecular Weight1
- 351.61
- 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).
- 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 |
|---|---|---|---|
| ω | 0.8140 | Relay (1.0) Calculated Property | |
| ΔfG° | 144.21 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -614.69 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 44.73 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.58 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.77 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.18 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.828 | Crippen Calculated Property | |
| McVol | 335.620 | ml/mol | McGowan Calculated Property |
| Pc | 1011.66 | kPa | Joback Calculated Property |
| Inp | 2295.00 | NIST | |
| Tboil | 643.62 | K | Relay (1.0) Calculated Property |
| Tc | 853.15 | K | Relay (1.0) Calculated Property |
| Tfus | 269.21 | K | Relay (1.0) Calculated Property |
| Vc | 1.210 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1104.16; 1219.99] | J/mol×K | [810.62; 1001.75] | 
|
| Cp,gas | 1104.16 | J/mol×K | 810.62 | Joback Calculated Property |
| Cp,gas | 1126.58 | J/mol×K | 842.48 | Joback Calculated Property |
| Cp,gas | 1147.67 | J/mol×K | 874.33 | Joback Calculated Property |
| Cp,gas | 1167.51 | J/mol×K | 906.19 | Joback Calculated Property |
| Cp,gas | 1186.13 | J/mol×K | 938.04 | Joback Calculated Property |
| Cp,gas | 1203.61 | J/mol×K | 969.90 | Joback Calculated Property |
| Cp,gas | 1219.99 | J/mol×K | 1001.75 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexanecarboxamide, N,N-bis(2-ethylhexyl)-.
Sources
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