- InChI
- InChI=1S/C24H30O4/c1-3-4-7-12-19(2)27-22(25)17-18-23(26)28-24(20-13-8-5-9-14-20)21-15-10-6-11-16-21/h5-6,8-11,13-16,19,24H,3-4,7,12,17-18H2,1-2H3
- InChI Key
- XBOPTAZEVBVRIT-UHFFFAOYSA-N
- Formula
- C24H30O4
- SMILES
-
CCCCCC(C)OC(=O)CCC(=O)OC(c1ccc
cc1)c1ccccc1 - Molecular Weight1
- 382.49
- 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 | -681.24 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 47.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 108.50 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.77 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 5.611 | Crippen Calculated Property | |
| McVol | 316.380 | ml/mol | McGowan Calculated Property |
| Inp | [2722.00; 2722.00] |
|
|
| Inp | 2722.00 | NIST | |
| Inp | 2722.00 | NIST | |
| Tboil | 648.31 | K | Relay (1.0) Calculated Property |
| Tfus | 307.42 | 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 | [1006.36; 1074.52] | J/mol×K | [917.64; 1137.74] |
|
| Cp,gas | 1006.36 | J/mol×K | 917.64 | Joback Calculated Property |
| Cp,gas | 1021.28 | J/mol×K | 954.32 | Joback Calculated Property |
| Cp,gas | 1034.69 | J/mol×K | 991.01 | Joback Calculated Property |
| Cp,gas | 1046.66 | J/mol×K | 1027.69 | Joback Calculated Property |
| Cp,gas | 1057.24 | J/mol×K | 1064.37 | Joback Calculated Property |
| Cp,gas | 1066.51 | J/mol×K | 1101.06 | Joback Calculated Property |
| Cp,gas | 1074.52 | J/mol×K | 1137.74 | Joback Calculated Property |
| η | [0.0000197; 0.0007654] | Pa×s | [467.74; 917.64] |
|
| η | 0.0007654 | Pa×s | 467.74 | Joback Calculated Property |
| η | 0.0002728 | Pa×s | 542.72 | Joback Calculated Property |
| η | 0.0001249 | Pa×s | 617.71 | Joback Calculated Property |
| η | 0.0000677 | Pa×s | 692.69 | Joback Calculated Property |
| η | 0.0000414 | Pa×s | 767.67 | Joback Calculated Property |
| η | 0.0000276 | Pa×s | 842.66 | Joback Calculated Property |
| η | 0.0000197 | Pa×s | 917.64 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, hept-2-yl diphenylmethyl 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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