- InChI
- InChI=1S/C21H18O/c22-21(19-14-8-3-9-15-19)16-20(17-10-4-1-5-11-17)18-12-6-2-7-13-18/h1-15,20H,16H2
- InChI Key
- WYRBITQXPQGTBL-UHFFFAOYSA-N
- Formula
- C21H18O
- SMILES
-
O=C(CC(c1ccccc1)c1ccccc1)c1ccc
cc1 - Molecular Weight1
- 286.37
- CAS
- 606-86-0
- Other Names
-
- Propiophenone, 3,3-diphenyl-
- 3,3-Diphenylpropiophenone
- Beta,beta-diphenylpropiophenone
- ω : Acentric Factor.
- 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 |
|---|---|---|---|
| ω | 0.5754 | Relay (... Calculated Property | |
| ΔfG° | 331.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 130.17 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 30.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 107.52 | kJ/mol | Relay (... Calculated Property |
| IE | 8.68 | eV | Relay (... Calculated Property |
| log10WS | -5.30 | Relay (... Calculated Property | |
| logPoct/wat | 5.091 | Crippen Calculated Property | |
| McVol | 237.040 | ml/mol | McGowan Calculated Property |
| Pc | 2123.64 | kPa | Joback Calculated Property |
| Tboil | 646.45 | K | Relay (... Calculated Property |
| Tc | 974.15 | K | Relay (... Calculated Property |
| Tfus | 340.69 | K | Relay (... Calculated Property |
| Vc | 0.844 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [675.79; 754.72] | J/mol×K | [813.35; 1073.57] | 
|
| Cp,gas | 675.79 | J/mol×K | 813.35 | Joback Calculated Property |
| Cp,gas | 692.31 | J/mol×K | 856.72 | Joback Calculated Property |
| Cp,gas | 707.29 | J/mol×K | 900.09 | Joback Calculated Property |
| Cp,gas | 720.87 | J/mol×K | 943.46 | Joback Calculated Property |
| Cp,gas | 733.20 | J/mol×K | 986.83 | Joback Calculated Property |
| Cp,gas | 744.43 | J/mol×K | 1030.20 | Joback Calculated Property |
| Cp,gas | 754.72 | J/mol×K | 1073.57 | Joback Calculated Property |
| η | [0.0000815; 0.0013118] | Pa×s | [440.62; 813.35] |
|
| η | 0.0013118 | Pa×s | 440.62 | Joback Calculated Property |
| η | 0.0006201 | Pa×s | 502.74 | Joback Calculated Property |
| η | 0.0003456 | Pa×s | 564.86 | Joback Calculated Property |
| η | 0.0002163 | Pa×s | 626.98 | Joback Calculated Property |
| η | 0.0001473 | Pa×s | 689.11 | Joback Calculated Property |
| η | 0.0001069 | Pa×s | 751.23 | Joback Calculated Property |
| η | 0.0000815 | Pa×s | 813.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Propanone, 1,3,3-triphenyl-.
Sources
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