- InChI
- InChI=1S/C13H16O3/c1-5-6-7-10-8-11(14-2)13(16-4)12(9-10)15-3/h5-9H,1H2,2-4H3/b7-6+
- InChI Key
- UAJSTXIBAXZQQK-VOTSOKGWSA-N
- Formula
- C13H16O3
- SMILES
- C=CC=Cc1cc(OC)c(OC)c(OC)c1
- Molecular Weight1
- 220.26
- 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).
- Inp : Non-polar retention indices.
- 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° | -4.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -263.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.31 | kJ/mol | Joback Calculated Property |
| log10WS | -3.35 | Crippen Calculated Property | |
| logPoct/wat | 2.912 | Crippen Calculated Property | |
| McVol | 179.280 | ml/mol | McGowan Calculated Property |
| Pc | 2189.73 | kPa | Joback Calculated Property |
| Inp | 1708.00 | NIST | |
| Tboil | 606.56 | K | Joback Calculated Property |
| Tc | 813.14 | K | Joback Calculated Property |
| Tfus | 360.10 | K | Joback Calculated Property |
| Vc | 0.670 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [432.86; 510.55] | J/mol×K | [606.56; 813.14] | 
|
| Cp,gas | 432.86 | J/mol×K | 606.56 | Joback Calculated Property |
| Cp,gas | 447.58 | J/mol×K | 640.99 | Joback Calculated Property |
| Cp,gas | 461.59 | J/mol×K | 675.42 | Joback Calculated Property |
| Cp,gas | 474.89 | J/mol×K | 709.85 | Joback Calculated Property |
| Cp,gas | 487.49 | J/mol×K | 744.28 | Joback Calculated Property |
| Cp,gas | 499.37 | J/mol×K | 778.71 | Joback Calculated Property |
| Cp,gas | 510.55 | J/mol×K | 813.14 | Joback Calculated Property |
| η | [0.0000866; 0.0005839] | Pa×s | [360.10; 606.56] |
|
| η | 0.0005839 | Pa×s | 360.10 | Joback Calculated Property |
| η | 0.0003609 | Pa×s | 401.18 | Joback Calculated Property |
| η | 0.0002440 | Pa×s | 442.25 | Joback Calculated Property |
| η | 0.0001763 | Pa×s | 483.33 | Joback Calculated Property |
| η | 0.0001340 | Pa×s | 524.41 | Joback Calculated Property |
| η | 0.0001060 | Pa×s | 565.48 | Joback Calculated Property |
| η | 0.0000866 | Pa×s | 606.56 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (E)-1-(2',4',5'-Trimethoxyphenyl)butadiene.
Sources
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