- InChI
- InChI=1S/C14H23N/c1-5-10(3)12-7-8-14(15)13(9-12)11(4)6-2/h7-11H,5-6,15H2,1-4H3
- InChI Key
- FSSAUWXQVAXTKJ-UHFFFAOYSA-N
- Formula
- C14H23N
- SMILES
- CCC(C)c1ccc(N)c(C(C)CC)c1
- Molecular Weight1
- 205.34
- 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).
- IE : Ionization energy (eV).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.5995 | Relay (1.0) Calculated Property | |
| ΔfH°gas | -143.20 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 23.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.52 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.36 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 4.296 | Crippen Calculated Property | |
| McVol | 194.340 | ml/mol | McGowan Calculated Property |
| Pc | 2088.84 | kPa | Joback Calculated Property |
| Tboil | 565.55 | K | Relay (1.0) Calculated Property |
| Tc | 786.03 | K | Relay (1.0) Calculated Property |
| Tfus | 299.94 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, 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 | [512.57; 604.75] | J/mol×K | [628.01; 840.41] | 
|
| Cp,gas | 512.57 | J/mol×K | 628.01 | Joback Calculated Property |
| Cp,gas | 530.34 | J/mol×K | 663.41 | Joback Calculated Property |
| Cp,gas | 547.10 | J/mol×K | 698.81 | Joback Calculated Property |
| Cp,gas | 562.88 | J/mol×K | 734.21 | Joback Calculated Property |
| Cp,gas | 577.72 | J/mol×K | 769.61 | Joback Calculated Property |
| Cp,gas | 591.67 | J/mol×K | 805.01 | Joback Calculated Property |
| Cp,gas | 604.75 | J/mol×K | 840.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Aniline, 2,4-di-sec-butyl-.
Sources
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