- InChI
- InChI=1S/C23H28O4/c1-3-20(18-12-7-5-8-13-18)26-22(24)16-11-17-23(25)27-21(4-2)19-14-9-6-10-15-19/h5-10,12-15,20-21H,3-4,11,16-17H2,1-2H3
- InChI Key
- FMSQSJWGXTVTPC-UHFFFAOYSA-N
- Formula
- C23H28O4
- SMILES
-
CCC(OC(=O)CCCC(=O)OC(CC)c1cccc
c1)c1ccccc1 - Molecular Weight1
- 368.47
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -681.66 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 45.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 115.70 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.67 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 5.546 | Crippen Calculated Property | |
| McVol | 302.290 | ml/mol | McGowan Calculated Property |
| Inp | 2688.00 | NIST | |
| Tboil | 655.86 | K | Relay (1.0) Calculated Property |
| Tfus | 339.92 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [947.20; 1015.85] | J/mol×K | [894.76; 1115.16] | 
|
| Cp,gas | 947.20 | J/mol×K | 894.76 | Joback Calculated Property |
| Cp,gas | 962.18 | J/mol×K | 931.49 | Joback Calculated Property |
| Cp,gas | 975.66 | J/mol×K | 968.23 | Joback Calculated Property |
| Cp,gas | 987.71 | J/mol×K | 1004.96 | Joback Calculated Property |
| Cp,gas | 998.39 | J/mol×K | 1041.70 | Joback Calculated Property |
| Cp,gas | 1007.75 | J/mol×K | 1078.43 | Joback Calculated Property |
| Cp,gas | 1015.85 | J/mol×K | 1115.16 | Joback Calculated Property |
| η | [0.0000230; 0.0008801] | Pa×s | [456.47; 894.76] |
|
| η | 0.0008801 | Pa×s | 456.47 | Joback Calculated Property |
| η | 0.0003152 | Pa×s | 529.52 | Joback Calculated Property |
| η | 0.0001448 | Pa×s | 602.57 | Joback Calculated Property |
| η | 0.0000787 | Pa×s | 675.62 | Joback Calculated Property |
| η | 0.0000482 | Pa×s | 748.66 | Joback Calculated Property |
| η | 0.0000322 | Pa×s | 821.71 | Joback Calculated Property |
| η | 0.0000230 | Pa×s | 894.76 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, di(1-phenylpropyl) ester.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
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