- InChI
- InChI=1S/C23H28O4/c1-3-4-6-9-18(2)26-22(24)16-17-23(25)27-21-14-12-20(13-15-21)19-10-7-5-8-11-19/h5,7-8,10-15,18H,3-4,6,9,16-17H2,1-2H3
- InChI Key
- FYAJAWZPUKQVSN-UHFFFAOYSA-N
- Formula
- C23H28O4
- SMILES
-
CCCCCC(C)OC(=O)CCC(=O)Oc1ccc(-
c2ccccc2)cc1 - 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 | -684.01 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 48.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 115.84 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.12 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 5.551 | Crippen Calculated Property | |
| McVol | 302.290 | ml/mol | McGowan Calculated Property |
| Inp | [2923.00; 2923.00] |
|
|
| Inp | 2923.00 | NIST | |
| Inp | 2923.00 | NIST | |
| Tboil | 684.27 | K | Relay (1.0) Calculated Property |
| Tfus | 346.85 | 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 | [945.74; 1013.22] | J/mol×K | [900.18; 1119.14] |
|
| Cp,gas | 945.74 | J/mol×K | 900.18 | Joback Calculated Property |
| Cp,gas | 960.46 | J/mol×K | 936.67 | Joback Calculated Property |
| Cp,gas | 973.73 | J/mol×K | 973.17 | Joback Calculated Property |
| Cp,gas | 985.59 | J/mol×K | 1009.66 | Joback Calculated Property |
| Cp,gas | 996.09 | J/mol×K | 1046.15 | Joback Calculated Property |
| Cp,gas | 1005.28 | J/mol×K | 1082.64 | Joback Calculated Property |
| Cp,gas | 1013.22 | J/mol×K | 1119.14 | Joback Calculated Property |
| η | [0.0000255; 0.0006023] | Pa×s | [483.99; 900.18] |
|
| η | 0.0006023 | Pa×s | 483.99 | Joback Calculated Property |
| η | 0.0002556 | Pa×s | 553.36 | Joback Calculated Property |
| η | 0.0001313 | Pa×s | 622.72 | Joback Calculated Property |
| η | 0.0000771 | Pa×s | 692.09 | Joback Calculated Property |
| η | 0.0000499 | Pa×s | 761.45 | Joback Calculated Property |
| η | 0.0000347 | Pa×s | 830.82 | Joback Calculated Property |
| η | 0.0000255 | Pa×s | 900.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, hept-2-yl 4-biphenyl 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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