- InChI
- InChI=1S/C22H20N2O3/c1-2-26-21-11-8-19(9-12-21)23-24-20-10-13-22(18(14-20)15-25)27-16-17-6-4-3-5-7-17/h3-15H,2,16H2,1H3/b24-23+
- InChI Key
- QMIMWGVGEBXJBU-WCWDXBQESA-N
- Formula
- C22H20N2O3
- SMILES
-
CCOc1ccc(N=Nc2ccc(OCc3ccccc3)c
(C=O)c2)cc1 - Molecular Weight1
- 360.41
- CAS
- 87730-61-8
- ω : Acentric Factor.
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°solid : Solid phase 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 | 0.9247 | Relay (... Calculated Property | |
| ΔcH°solid | -11864.80 | kJ/mol | NIST |
| ΔfG° | 177.09 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | 36.53 | kJ/mol | Relay (... Calculated Property |
| ΔfH°solid | 349.20 | kJ/mol | NIST |
| ΔvapH° | 115.62 | kJ/mol | Relay (... Calculated Property |
| IE | 8.15 | eV | Relay (... Calculated Property |
| log10WS | -5.74 | Relay (... Calculated Property | |
| logPoct/wat | 5.892 | Crippen Calculated Property | |
| McVol | 278.530 | ml/mol | McGowan Calculated Property |
| Pc | 1474.75 | kPa | Joback Calculated Property |
| Tboil | 732.35 | K | Relay (... Calculated Property |
| Tc | 1029.85 | K | Relay (... Calculated Property |
| Tfus | 384.00 | K | Relay (... Calculated Property |
| Vc | 1.006 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 4-Ethoxy-3'-formyl-4'-benzyloxyazobenzene.
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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