- InChI
- InChI=1S/C10H15N/c1-3-8-6-5-7-9(4-2)10(8)11/h5-7H,3-4,11H2,1-2H3
- InChI Key
- FOYHNROGBXVLLX-UHFFFAOYSA-N
- Formula
- C10H15N
- SMILES
- CCc1cccc(CC)c1N
- Molecular Weight1
- 149.23
- CAS
- 579-66-8
- Other Names
-
- 2,6-DIETHYLBENZENAMINE
- 2,6-Diethylaniline
- 2,6-diethylaniline (DEA)
- Aniline, 2,6-diethyl-
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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° | 192.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2.35 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.90 ± 0.60 | kJ/mol | NIST |
| IE | 7.77 | eV | NIST |
| log10WS | -2.35 | Aq. Sol... | |
| logPoct/wat | 2.394 | Crippen Calculated Property | |
| McVol | 137.980 | ml/mol | McGowan Calculated Property |
| Pc | 3018.96 | kPa | Joback Calculated Property |
| Inp | [227.43; 1329.00] |
|
|
| Inp | 1295.60 | NIST | |
| Inp | 1329.00 | NIST | |
| Inp | 227.43 | NIST | |
| Inp | 227.43 | NIST | |
| Tboil | 537.37 | K | Joback Calculated Property |
| Tc | 755.40 | K | Joback Calculated Property |
| Tfus | 276.65 | K | Aq. Sol... |
| Vc | 0.516 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [316.09; 390.61] | J/mol×K | [537.37; 755.40] |
|
| Cp,gas | 316.09 | J/mol×K | 537.37 | Joback Calculated Property |
| Cp,gas | 330.39 | J/mol×K | 573.71 | Joback Calculated Property |
| Cp,gas | 343.90 | J/mol×K | 610.05 | Joback Calculated Property |
| Cp,gas | 356.65 | J/mol×K | 646.38 | Joback Calculated Property |
| Cp,gas | 368.66 | J/mol×K | 682.72 | Joback Calculated Property |
| Cp,gas | 379.98 | J/mol×K | 719.06 | Joback Calculated Property |
| Cp,gas | 390.61 | J/mol×K | 755.40 | Joback Calculated Property |
| ΔvapH | 69.50 ± 0.60 | kJ/mol | 306.00 | NIST |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 387.20 | K | 1.30 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.63] | kPa | [381.92; 546.66] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.44406e+01 | |||
| Coefficient B | -4.23692e+03 | |||
| Coefficient C | -8.25550e+01 | |||
| Temperature range, min. | 381.92 | |||
| Temperature range, max. | 546.66 | |||
| Pvap | 1.33 | kPa | 381.92 | Calculated Property |
| Pvap | 3.01 | kPa | 400.22 | Calculated Property |
| Pvap | 6.23 | kPa | 418.53 | Calculated Property |
| Pvap | 11.96 | kPa | 436.83 | Calculated Property |
| Pvap | 21.52 | kPa | 455.14 | Calculated Property |
| Pvap | 36.65 | kPa | 473.44 | Calculated Property |
| Pvap | 59.52 | kPa | 491.75 | Calculated Property |
| Pvap | 92.72 | kPa | 510.05 | Calculated Property |
| Pvap | 139.29 | kPa | 528.36 | Calculated Property |
| Pvap | 202.63 | kPa | 546.66 | Calculated Property |
| Pvap | [3.68e-05; 3064.11] | kPa | [276.65; 678.00] |
KDB Vap...
|
| Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
| Coefficient A | 1.46372e+02 | |||
| Coefficient B | -1.50264e+04 | |||
| Coefficient C | -1.82753e+01 | |||
| Coefficient D | 6.43473e-06 | |||
| Temperature range, min. | 276.65 | |||
| Temperature range, max. | 678.00 | |||
| Pvap | 3.68e-05 | kPa | 276.65 | Calculated Property |
| Pvap | 5.36e-03 | kPa | 321.24 | Calculated Property |
| Pvap | 0.18 | kPa | 365.84 | Calculated Property |
| Pvap | 2.41 | kPa | 410.43 | Calculated Property |
| Pvap | 16.94 | kPa | 455.03 | Calculated Property |
| Pvap | 76.90 | kPa | 499.62 | Calculated Property |
| Pvap | 255.70 | kPa | 544.22 | Calculated Property |
| Pvap | 679.25 | kPa | 588.81 | Calculated Property |
| Pvap | 1531.83 | kPa | 633.41 | Calculated Property |
| Pvap | 3064.11 | kPa | 678.00 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzenamine, 2,6-diethyl-.
Sources
- KDB Vapor Pressure Data
- Crippen Method
- Joback Method
- KDB
- Aqueous Solubility Prediction Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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