- InChI
- InChI=1S/C21H25NO3/c1-3-5-6-15-25-20-13-7-17(8-14-20)16-22-19-11-9-18(10-12-19)21(23)24-4-2/h7-14,16H,3-6,15H2,1-2H3
- InChI Key
- ZQZICUICLNBRNL-UHFFFAOYSA-N
- Formula
- C21H25NO3
- SMILES
-
CCCCCOc1ccc(C=Nc2ccc(C(=O)OCC)
cc2)cc1 - Molecular Weight1
- 339.43
- CAS
- 37168-42-6
- 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).
- 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 | 0.9381 | Relay (1.0) Calculated Property | |
| ΔfG° | -17.51 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -380.05 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 108.97 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.60 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.83 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.183 | Crippen Calculated Property | |
| McVol | 278.220 | ml/mol | McGowan Calculated Property |
| Pc | 1394.37 | kPa | Joback Calculated Property |
| Tboil | 694.49 | K | Relay (1.0) Calculated Property |
| Tc | 913.13 | K | Relay (1.0) Calculated Property |
| Tfus | 358.70 | K | Relay (1.0) Calculated Property |
| Vc | 1.011 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
![Benzonitrile, 4-[[[4-(hexyloxy)phenyl]methylene]amino]-.](data:image/png;base64,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)
Find more compounds similar to Ethyl p-(p-pentyloxybenzylidene)aminobenzoate.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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