- InChI
- InChI=1S/C16H27N/c1-12(2)11-13(3)17-15-9-7-14(8-10-15)16(4,5)6/h7-10,12-13,17H,11H2,1-6H3
- InChI Key
- FMRJPZKPQMPPAA-UHFFFAOYSA-N
- Formula
- C16H27N
- SMILES
- CC(C)CC(C)Nc1ccc(C(C)(C)C)cc1
- Molecular Weight1
- 233.39
- 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).
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 273.97 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -114.35 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.51 | kJ/mol | Joback Calculated Property |
| log10WS | -4.76 | Crippen Calculated Property | |
| logPoct/wat | 4.831 | Crippen Calculated Property | |
| McVol | 222.520 | ml/mol | McGowan Calculated Property |
| Pc | 1750.67 | kPa | Joback Calculated Property |
| Tboil | 643.20 | K | Joback Calculated Property |
| Tc | 851.92 | K | Joback Calculated Property |
| Tfus | 334.10 | K | Joback Calculated Property |
| Vc | 0.836 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [608.63; 710.65] | J/mol×K | [643.20; 851.92] | 
|
| Cp,gas | 608.63 | J/mol×K | 643.20 | Joback Calculated Property |
| Cp,gas | 628.48 | J/mol×K | 677.99 | Joback Calculated Property |
| Cp,gas | 647.10 | J/mol×K | 712.77 | Joback Calculated Property |
| Cp,gas | 664.56 | J/mol×K | 747.56 | Joback Calculated Property |
| Cp,gas | 680.93 | J/mol×K | 782.34 | Joback Calculated Property |
| Cp,gas | 696.27 | J/mol×K | 817.13 | Joback Calculated Property |
| Cp,gas | 710.65 | J/mol×K | 851.92 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Aniline, 4-tert-butyl-n-(1,3-dimethylbutyl)-.
Sources
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