- InChI
- InChI=1S/C13H19NO3/c1-3-16-13(17-4-2)10-14-9-11-7-5-6-8-12(11)15/h5-9,13,15H,3-4,10H2,1-2H3/b14-9-
- InChI Key
- QXNBLBWJCRLMAR-ZROIWOOFSA-N
- Formula
- C13H19NO3
- SMILES
- CCOC(CN=Cc1ccccc1O)OCC
- Molecular Weight1
- 237.29
- CAS
- 116632-97-4
- 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 | 0.7328 | Relay (1.0) Calculated Property | |
| ΔfG° | -88.81 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -428.52 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 84.48 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.16 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.66 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.210 | Crippen Calculated Property | |
| McVol | 193.560 | ml/mol | McGowan Calculated Property |
| Pc | 2231.30 | kPa | Joback Calculated Property |
| Tboil | 590.13 | K | Relay (1.0) Calculated Property |
| Tc | 795.57 | K | Relay (1.0) Calculated Property |
| Tfus | 286.21 | K | Relay (1.0) Calculated Property |
| Vc | 0.681 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Benzylidenimine,n-(2,2-diethoxyethyl)-o-hydroxy-.
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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