- InChI
- InChI=1S/C13H9ClN2O/c14-13(17)10-6-8-12(9-7-10)16-15-11-4-2-1-3-5-11/h1-9H/b16-15+
- InChI Key
- RYMHZBAYPLCCAC-FOCLMDBBSA-N
- Formula
- C13H9ClN2O
- SMILES
- O=C(Cl)c1ccc(/N=N/c2ccccc2)cc1
- Molecular Weight1
- 244.68
- Other Names
-
- 4-phenylazobenzoyl chloride
- 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | 204.04 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 92.12 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.95 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.36 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.481 | Crippen Calculated Property | |
| McVol | 175.980 | ml/mol | McGowan Calculated Property |
| Pc | 2367.97 | kPa | Joback Calculated Property |
| Tboil | 625.74 | K | Relay (1.0) Calculated Property |
| Tc | 900.29 | K | Relay (1.0) Calculated Property |
| Tfus | 364.59 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Similar Compounds
![Benzaldehyde, 4-[[4-(dimethylamino)phenyl]azo]-.](data:image/png;base64,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)
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Sources
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