- InChI
- InChI=1S/C14H19NO2/c1-17-13-9-7-12(8-10-13)15-14(16)11-5-3-2-4-6-11/h7-11H,2-6H2,1H3,(H,15,16)
- InChI Key
- HIXKKTIDKQKPNN-UHFFFAOYSA-N
- Formula
- C14H19NO2
- SMILES
- COc1ccc(NC(=O)C2CCCCC2)cc1
- Molecular Weight1
- 233.31
- CAS
- 315712-26-6
- Other Names
-
- Cyclohexanecarboxamide, N-(4-methoxyphenyl)-
- 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 | 0.6322 | Relay (1.0) Calculated Property | |
| ΔfG° | 49.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -306.89 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 25.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.56 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.74 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.74 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.214 | Crippen Calculated Property | |
| McVol | 190.920 | ml/mol | McGowan Calculated Property |
| Pc | 2545.61 | kPa | Joback Calculated Property |
| Inp | [2137.00; 2137.00] |
|
|
| Inp | 2137.00 | NIST | |
| Inp | 2137.00 | NIST | |
| Tboil | 629.96 | K | Relay (1.0) Calculated Property |
| Tc | 881.37 | K | Relay (1.0) Calculated Property |
| Tfus | 401.79 | K | Relay (1.0) Calculated Property |
| Vc | 0.666 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [541.69; 631.54] | J/mol×K | [697.39; 931.16] |
|
| Cp,gas | 541.69 | J/mol×K | 697.39 | Joback Calculated Property |
| Cp,gas | 559.98 | J/mol×K | 736.35 | Joback Calculated Property |
| Cp,gas | 576.88 | J/mol×K | 775.31 | Joback Calculated Property |
| Cp,gas | 592.46 | J/mol×K | 814.28 | Joback Calculated Property |
| Cp,gas | 606.73 | J/mol×K | 853.24 | Joback Calculated Property |
| Cp,gas | 619.74 | J/mol×K | 892.20 | Joback Calculated Property |
| Cp,gas | 631.54 | J/mol×K | 931.16 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Aniline, N-cyclohexylcarbonyl-4-methoxy-.
Sources
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