- InChI
- InChI=1S/C21H15NO2/c23-20(16-10-4-1-5-11-16)19(22-18-14-8-3-9-15-18)21(24)17-12-6-2-7-13-17/h1-15H
- InChI Key
- NMYSMCUGIBQIHP-UHFFFAOYSA-N
- Formula
- C21H15NO2
- SMILES
-
O=C(C(=Nc1ccccc1)C(=O)c1ccccc1
)c1ccccc1 - Molecular Weight1
- 313.35
- CAS
- 24416-28-2
- Other Names
-
- 1,3-Diphenyl-2-phenylimino-propan-1,3-dione
- 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | 80.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.05 | kJ/mol | Joback Calculated Property |
| IE | 8.01 ± 0.05 | eV | NIST |
| log10WS | -5.40 | Crippen Calculated Property | |
| logPoct/wat | 4.525 | Crippen Calculated Property | |
| McVol | 244.290 | ml/mol | McGowan Calculated Property |
| Pc | 2038.23 | kPa | Joback Calculated Property |
| Tboil | 944.22 | K | Joback Calculated Property |
| Tc | 1217.67 | K | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propane-1,3-dione, 1,3-diphenyl-2-(phenylimino)-.
Sources
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