- InChI
- InChI=1S/C5H14N2/c1-3-7-5-4-6-2/h6-7H,3-5H2,1-2H3
- InChI Key
- MXJYVLYENVWKQX-UHFFFAOYSA-N
- Formula
- C5H14N2
- SMILES
- CCNCCNC
- Molecular Weight1
- 102.18
- CAS
- 111-37-5
- Other Names
-
- Ethylenediamine, N-ethyl-N'-methyl-
- N-Ethyl-N'-methylethylenediamine
- 2,5-Diazaheptane
- ethyl(2-(methylamino)ethyl)amine
- 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).
- 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 | 0.4343 | Relay (1.0) Calculated Property | |
| ΔfG° | 170.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -56.94 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 18.90 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.61 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.50 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | -0.185 | Crippen Calculated Property | |
| McVol | 101.270 | ml/mol | McGowan Calculated Property |
| Pc | 3577.07 | kPa | Joback Calculated Property |
| Tboil | 405.39 | K | Relay (1.0) Calculated Property |
| Tc | 582.35 | K | Relay (1.0) Calculated Property |
| Tfus | 218.14 | K | Relay (1.0) Calculated Property |
| Vc | 0.384 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Log10 of Water solubility in mol/l for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [143.92; 351.06] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -4.07700e+00 | |||
| Coefficient B | 6.31240e-01 | |||
| Coefficient C | -3.45400e-04 | |||
| Coefficient D | 6.93000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 143.92 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 179.08 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 210.69 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 238.98 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 264.15 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 286.44 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 306.05 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 323.22 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 338.15 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 351.06 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Ethanediamine, N-ethyl-N'-methyl-.
Sources
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