- InChI
- InChI=1S/C19H18O3/c1-21-18-11-5-15(6-12-18)3-9-17(20)10-4-16-7-13-19(22-2)14-8-16/h3-14H,1-2H3/b9-3+,10-4+
- InChI Key
- IOZVKDXPBWBUKY-LQIBPGRFSA-N
- Formula
- C19H18O3
- SMILES
-
COc1ccc(C=CC(=O)C=Cc2ccc(OC)cc
2)cc1 - Molecular Weight1
- 294.34
- CAS
- 2051-07-2
- Other Names
-
- Dianisylideneacetone
- di(4-Methoxybenzylidene)acetone
- 1,4-Pentadien-3-one, 1,5-bis(p-methoxyphenyl)-
- 1,4-Pentadien-3-one, 1,5-bis(4-methoxyphenyl)-
- 1,5-Bis(p-methoxyphenyl)-3-pentadienone
- Bis(4-methoxybenzylidene)acetone
- Dianisalacetone
- 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 | 0.6989 | Relay (1.0) Calculated Property | |
| ΔfG° | 136.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -154.14 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 36.65 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 109.89 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.83 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.13 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.000 | Crippen Calculated Property | |
| McVol | 235.760 | ml/mol | McGowan Calculated Property |
| Pc | 1928.74 | kPa | Joback Calculated Property |
| Tboil | 677.79 | K | Relay (1.0) Calculated Property |
| Tc | 917.06 | K | Relay (1.0) Calculated Property |
| Tfus | 447.55 | K | Relay (1.0) Calculated Property |
| Vc | 0.822 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [657.13; 731.44] | J/mol×K | [804.47; 1040.15] | 
|
| Cp,gas | 657.13 | J/mol×K | 804.47 | Joback Calculated Property |
| Cp,gas | 672.20 | J/mol×K | 843.75 | Joback Calculated Property |
| Cp,gas | 686.10 | J/mol×K | 883.03 | Joback Calculated Property |
| Cp,gas | 698.91 | J/mol×K | 922.31 | Joback Calculated Property |
| Cp,gas | 710.69 | J/mol×K | 961.59 | Joback Calculated Property |
| Cp,gas | 721.51 | J/mol×K | 1000.87 | Joback Calculated Property |
| Cp,gas | 731.44 | J/mol×K | 1040.15 | Joback Calculated Property |
| η | [0.0000503; 0.0004836] | Pa×s | [466.00; 804.47] |
|
| η | 0.0004836 | Pa×s | 466.00 | Joback Calculated Property |
| η | 0.0002706 | Pa×s | 522.41 | Joback Calculated Property |
| η | 0.0001695 | Pa×s | 578.82 | Joback Calculated Property |
| η | 0.0001154 | Pa×s | 635.24 | Joback Calculated Property |
| η | 0.0000836 | Pa×s | 691.65 | Joback Calculated Property |
| η | 0.0000636 | Pa×s | 748.06 | Joback Calculated Property |
| η | 0.0000503 | Pa×s | 804.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to di-p-Anisylideneacetone.
Sources
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