- InChI
- InChI=1S/C16H23NO/c1-3-17(15-11-7-8-13(2)12-15)16(18)14-9-5-4-6-10-14/h7-8,11-12,14H,3-6,9-10H2,1-2H3
- InChI Key
- NARFYVMKRROFNU-UHFFFAOYSA-N
- Formula
- C16H23NO
- SMILES
- CCN(C(=O)C1CCCCC1)c1cccc(C)c1
- Molecular Weight1
- 245.36
- 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 | 0.5887 | Relay (1.0) Calculated Property | |
| ΔfG° | 192.93 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -216.04 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 27.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.22 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.94 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.03 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.928 | Crippen Calculated Property | |
| McVol | 213.230 | ml/mol | McGowan Calculated Property |
| Pc | 2119.73 | kPa | Joback Calculated Property |
| Inp | 1823.00 | NIST | |
| Tboil | 619.85 | K | Relay (1.0) Calculated Property |
| Tc | 854.08 | K | Relay (1.0) Calculated Property |
| Tfus | 345.08 | K | Relay (1.0) Calculated Property |
| Vc | 0.762 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [604.53; 706.69] | J/mol×K | [683.00; 909.69] | 
|
| Cp,gas | 604.53 | J/mol×K | 683.00 | Joback Calculated Property |
| Cp,gas | 625.00 | J/mol×K | 720.78 | Joback Calculated Property |
| Cp,gas | 643.99 | J/mol×K | 758.56 | Joback Calculated Property |
| Cp,gas | 661.59 | J/mol×K | 796.34 | Joback Calculated Property |
| Cp,gas | 677.86 | J/mol×K | 834.12 | Joback Calculated Property |
| Cp,gas | 692.87 | J/mol×K | 871.90 | Joback Calculated Property |
| Cp,gas | 706.69 | J/mol×K | 909.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexanecarboxamide, N-ethyl-N-(3-methylphenyl)-.
Sources
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