- InChI
- InChI=1S/C15H25N/c1-11-9-12(7-8-13(11)16)15(5,6)10-14(2,3)4/h7-9H,10,16H2,1-6H3
- InChI Key
- IYHTUEGIFDQRBA-UHFFFAOYSA-N
- Formula
- C15H25N
- SMILES
- Cc1cc(C(C)(C)CC(C)(C)C)ccc1N
- Molecular Weight1
- 219.37
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.5716 | Relay (1.0) Calculated Property | |
| ΔfusH° | 18.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.41 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.58 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 4.291 | Crippen Calculated Property | |
| McVol | 208.430 | ml/mol | McGowan Calculated Property |
| Pc | 1954.41 | kPa | Joback Calculated Property |
| Tboil | 577.28 | K | Relay (1.0) Calculated Property |
| Tc | 788.80 | K | Relay (1.0) Calculated Property |
| Tfus | 329.47 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Volume, Enthalpy of formation at standard conditions, 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 | [570.00; 666.62] | J/mol×K | [645.31; 869.88] | 
|
| Cp,gas | 570.00 | J/mol×K | 645.31 | Joback Calculated Property |
| Cp,gas | 589.06 | J/mol×K | 682.74 | Joback Calculated Property |
| Cp,gas | 606.81 | J/mol×K | 720.17 | Joback Calculated Property |
| Cp,gas | 623.35 | J/mol×K | 757.59 | Joback Calculated Property |
| Cp,gas | 638.76 | J/mol×K | 795.02 | Joback Calculated Property |
| Cp,gas | 653.16 | J/mol×K | 832.45 | Joback Calculated Property |
| Cp,gas | 666.62 | J/mol×K | 869.88 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Aniline, 2-methyl-4-(1',1',3',3'-tetramethylbutyl)-.
Sources
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