- InChI
- InChI=1S/C20H26O4/c1-3-5-7-9-14-23-19(21)17-12-11-13-18(16-17)20(22)24-15-10-8-6-4-2/h5-8,11-13,16H,3-4,9-10,14-15H2,1-2H3/b7-5+,8-6+
- InChI Key
- WZABUZCDGHEXSO-KQQUZDAGSA-N
- Formula
- C20H26O4
- SMILES
-
CCC=CCCOC(=O)c1cccc(C(=O)OCCC=
CCC)c1 - Molecular Weight1
- 330.42
- 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° | -87.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -486.23 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.28 | kJ/mol | Joback Calculated Property |
| log10WS | -5.85 | Crippen Calculated Property | |
| logPoct/wat | 4.713 | Crippen Calculated Property | |
| McVol | 275.180 | ml/mol | McGowan Calculated Property |
| Pc | 1450.14 | kPa | Joback Calculated Property |
| Inp | 2414.00 | NIST | |
| Tboil | 849.56 | K | Joback Calculated Property |
| Tc | 1058.23 | K | Joback Calculated Property |
| Tfus | 488.26 | K | Joback Calculated Property |
| Vc | 1.056 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [824.64; 901.72] | J/mol×K | [849.56; 1058.23] | 
|
| Cp,gas | 824.64 | J/mol×K | 849.56 | Joback Calculated Property |
| Cp,gas | 839.86 | J/mol×K | 884.34 | Joback Calculated Property |
| Cp,gas | 854.07 | J/mol×K | 919.12 | Joback Calculated Property |
| Cp,gas | 867.31 | J/mol×K | 953.90 | Joback Calculated Property |
| Cp,gas | 879.63 | J/mol×K | 988.67 | Joback Calculated Property |
| Cp,gas | 891.09 | J/mol×K | 1023.45 | Joback Calculated Property |
| Cp,gas | 901.72 | J/mol×K | 1058.23 | Joback Calculated Property |
| η | [0.0000417; 0.0005054] | Pa×s | [488.26; 849.56] |
|
| η | 0.0005054 | Pa×s | 488.26 | Joback Calculated Property |
| η | 0.0002654 | Pa×s | 548.48 | Joback Calculated Property |
| η | 0.0001583 | Pa×s | 608.69 | Joback Calculated Property |
| η | 0.0001036 | Pa×s | 668.91 | Joback Calculated Property |
| η | 0.0000727 | Pa×s | 729.13 | Joback Calculated Property |
| η | 0.0000539 | Pa×s | 789.34 | Joback Calculated Property |
| η | 0.0000417 | Pa×s | 849.56 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, di(trans-hex-3-enyl) ester.
Sources
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