- InChI
- InChI=1S/C12H16N2O2/c1-4-16-12(15)10-5-7-11(8-6-10)13-9-14(2)3/h5-9H,4H2,1-3H3
- InChI Key
- GHHKNAGPUBEDLN-UHFFFAOYSA-N
- Formula
- C12H16N2O2
- SMILES
- CCOC(=O)c1ccc(N=CN(C)C)cc1
- Molecular Weight1
- 220.27
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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).
- Inp : Non-polar retention indices.
- 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 | 0.6569 | Relay (... Calculated Property | |
| ΔfG° | 42.74 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -226.58 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 80.86 | kJ/mol | Relay (... Calculated Property |
| IE | 7.31 | eV | Relay (... Calculated Property |
| log10WS | -2.99 | Relay (... Calculated Property | |
| logPoct/wat | 2.085 | Crippen Calculated Property | |
| McVol | 179.280 | ml/mol | McGowan Calculated Property |
| Pc | 2235.52 | kPa | Joback Calculated Property |
| Inp | [1987.00; 1987.00] |
|
|
| Inp | 1987.00 | NIST | |
| Inp | 1987.00 | NIST | |
| Tboil | 603.84 | K | Relay (... Calculated Property |
| Tc | 781.07 | K | Relay (... Calculated Property |
| Tfus | 403.34 | K | Relay (... Calculated Property |
| Vc | 0.658 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
![Benzoic acid, p-[[(dimethylamino)methylene]amino]-, methyl 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)
Find more compounds similar to 4-Aminobenzoic acid, N-dimethylaminomethylene-, ethyl ester.
Sources
- Cheméo Relay (1.0)
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- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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