- InChI
- InChI=1S/C18H33N3/c1-5-19(6-2)14-16-21(17-15-20(7-3)8-4)18-12-10-9-11-13-18/h9-13H,5-8,14-17H2,1-4H3
- InChI Key
- FPVVUDMZUOYOEU-UHFFFAOYSA-N
- Formula
- C18H33N3
- SMILES
- CCN(CC)CCN(CCN(CC)CC)c1ccccc1
- Molecular Weight1
- 291.47
- CAS
- 5427-46-3
- Other Names
-
- 1,1,7,7-Tetraethyl-4-phenyl diethylene triamine
- N,N-Bis(2-diethylaminoethyl)aniline
- 1,2-Ethanediamine, N-[2-(diethylamino)ethyl]-N',N'-diethyl-N-phenyl-
- Diethylenetriamine, 1,1,7,7-tetraethyl-4-phenyl-
- N-[2-(diethylamino)ethyl]-N',N'-diethyl-N-phenylethylenediamine
- 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).
- 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 | 0.7266 | Relay (1.0) Calculated Property | |
| ΔfG° | 545.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -33.04 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 45.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.81 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.05 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.48 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.177 | Crippen Calculated Property | |
| McVol | 270.660 | ml/mol | McGowan Calculated Property |
| Pc | 1455.68 | kPa | Joback Calculated Property |
| Tboil | 614.03 | K | Relay (1.0) Calculated Property |
| Tc | 795.61 | K | Relay (1.0) Calculated Property |
| Tfus | 247.94 | K | Relay (1.0) Calculated Property |
| Vc | 0.985 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [776.57; 881.82] | J/mol×K | [675.24; 856.60] | 
|
| Cp,gas | 776.57 | J/mol×K | 675.24 | Joback Calculated Property |
| Cp,gas | 796.68 | J/mol×K | 705.47 | Joback Calculated Property |
| Cp,gas | 815.69 | J/mol×K | 735.69 | Joback Calculated Property |
| Cp,gas | 833.65 | J/mol×K | 765.92 | Joback Calculated Property |
| Cp,gas | 850.62 | J/mol×K | 796.15 | Joback Calculated Property |
| Cp,gas | 866.66 | J/mol×K | 826.37 | Joback Calculated Property |
| Cp,gas | 881.82 | J/mol×K | 856.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N,N'-Bis(diethylaminoethyl)aniline.
Sources
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