- InChI
- InChI=1S/C17H14O/c18-17(13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16/h1-14H/b13-11+,14-12+
- InChI Key
- WMKGGPCROCCUDY-PHEQNACWSA-N
- Formula
- C17H14O
- SMILES
- O=C(C=Cc1ccccc1)C=Cc1ccccc1
- Molecular Weight1
- 234.29
- CAS
- 35225-79-7
- Other Names
-
- 1,4-Pentadien-3-one, 1,5-diphenyl-, (1E,4E)-
- dibenzylideneacetone
- 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).
- 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° | 348.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 200.71 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.65 | kJ/mol | Joback Calculated Property |
| log10WS | -4.47 | Crippen Calculated Property | |
| logPoct/wat | 3.982 | Crippen Calculated Property | |
| McVol | 195.840 | ml/mol | McGowan Calculated Property |
| Pc | 2448.32 | kPa | Joback Calculated Property |
| Tboil | 703.91 | K | Joback Calculated Property |
| Tc | 954.96 | K | Joback Calculated Property |
| Tfus | 373.96 | K | Joback Calculated Property |
| Vc | 0.738 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [498.70; 576.44] | J/mol×K | [703.91; 954.96] | 
|
| Cp,gas | 498.70 | J/mol×K | 703.91 | Joback Calculated Property |
| Cp,gas | 514.49 | J/mol×K | 745.75 | Joback Calculated Property |
| Cp,gas | 528.96 | J/mol×K | 787.59 | Joback Calculated Property |
| Cp,gas | 542.24 | J/mol×K | 829.43 | Joback Calculated Property |
| Cp,gas | 554.49 | J/mol×K | 871.27 | Joback Calculated Property |
| Cp,gas | 565.84 | J/mol×K | 913.11 | Joback Calculated Property |
| Cp,gas | 576.44 | J/mol×K | 954.96 | Joback Calculated Property |
| η | [0.0001044; 0.0015983] | Pa×s | [373.96; 703.91] |
|
| η | 0.0015983 | Pa×s | 373.96 | Joback Calculated Property |
| η | 0.0007579 | Pa×s | 428.95 | Joback Calculated Property |
| η | 0.0004258 | Pa×s | 483.94 | Joback Calculated Property |
| η | 0.0002691 | Pa×s | 538.93 | Joback Calculated Property |
| η | 0.0001851 | Pa×s | 593.93 | Joback Calculated Property |
| η | 0.0001357 | Pa×s | 648.92 | Joback Calculated Property |
| η | 0.0001044 | Pa×s | 703.91 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to trans,trans-Dibenzylideneacetone.
Sources
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