- InChI
- InChI=1S/C23H18O4/c1-27-19-14-12-18(13-15-19)23(26)20(21(24)16-8-4-2-5-9-16)22(25)17-10-6-3-7-11-17/h2-15,20H,1H3
- InChI Key
- FKAGMSHKOJSCSM-UHFFFAOYSA-N
- Formula
- C23H18O4
- SMILES
-
COc1ccc(C(=O)C(C(=O)c2ccccc2)C
(=O)c2ccccc2)cc1 - Molecular Weight1
- 358.39
- CAS
- 111473-17-7
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion 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 |
|---|---|---|---|
| ΔfG° | -23.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -295.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.54 | kJ/mol | Joback Calculated Property |
| IE | 7.79 | eV | NIST |
| log10WS | -5.79 | Crippen Calculated Property | |
| logPoct/wat | 4.260 | Crippen Calculated Property | |
| McVol | 274.230 | ml/mol | McGowan Calculated Property |
| Pc | 1944.08 | kPa | Joback Calculated Property |
| Tboil | 994.25 | K | Joback Calculated Property |
| Tc | 1251.34 | K | Joback Calculated Property |
| Tfus | 597.77 | K | Joback Calculated Property |
| Vc | 1.030 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [831.86; 879.04] | J/mol×K | [994.25; 1251.34] | 
|
| Cp,gas | 831.86 | J/mol×K | 994.25 | Joback Calculated Property |
| Cp,gas | 842.75 | J/mol×K | 1037.10 | Joback Calculated Property |
| Cp,gas | 852.28 | J/mol×K | 1079.95 | Joback Calculated Property |
| Cp,gas | 860.57 | J/mol×K | 1122.80 | Joback Calculated Property |
| Cp,gas | 867.72 | J/mol×K | 1165.65 | Joback Calculated Property |
| Cp,gas | 873.84 | J/mol×K | 1208.50 | Joback Calculated Property |
| Cp,gas | 879.04 | J/mol×K | 1251.34 | Joback Calculated Property |
| η | [0.0000443; 0.0004346] | Pa×s | [597.77; 994.25] |
|
| η | 0.0004346 | Pa×s | 597.77 | Joback Calculated Property |
| η | 0.0002458 | Pa×s | 663.85 | Joback Calculated Property |
| η | 0.0001541 | Pa×s | 729.93 | Joback Calculated Property |
| η | 0.0001044 | Pa×s | 796.01 | Joback Calculated Property |
| η | 0.0000751 | Pa×s | 862.09 | Joback Calculated Property |
| η | 0.0000566 | Pa×s | 928.17 | Joback Calculated Property |
| η | 0.0000443 | Pa×s | 994.25 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propane-1,3-dione, 1,3-diphenyl-2-(4-methoxybenzoyl)-.
Sources
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