- InChI
- InChI=1S/C20H36O4/c1-3-4-5-6-7-8-12-17(2)23-19(21)15-11-16-20(22)24-18-13-9-10-14-18/h17-18H,3-16H2,1-2H3
- InChI Key
- QHSDXIQEILYDNR-UHFFFAOYSA-N
- Formula
- C20H36O4
- SMILES
-
CCCCCCCCC(C)OC(=O)CCCC(=O)OC1C
CCC1 - Molecular Weight1
- 340.50
- 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).
- 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 | -1055.61 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 46.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 101.12 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 5.325 | Crippen Calculated Property | |
| McVol | 296.680 | ml/mol | McGowan Calculated Property |
| Inp | [2308.00; 2308.00] |
|
|
| Inp | 2308.00 | NIST | |
| Inp | 2308.00 | NIST | |
| Tboil | 622.31 | K | Relay (1.0) Calculated Property |
| Tfus | 273.13 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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 | [945.71; 1042.43] | J/mol×K | [788.48; 977.41] |
|
| Cp,gas | 945.71 | J/mol×K | 788.48 | Joback Calculated Property |
| Cp,gas | 964.87 | J/mol×K | 819.97 | Joback Calculated Property |
| Cp,gas | 982.78 | J/mol×K | 851.46 | Joback Calculated Property |
| Cp,gas | 999.46 | J/mol×K | 882.94 | Joback Calculated Property |
| Cp,gas | 1014.95 | J/mol×K | 914.43 | Joback Calculated Property |
| Cp,gas | 1029.26 | J/mol×K | 945.92 | Joback Calculated Property |
| Cp,gas | 1042.43 | J/mol×K | 977.41 | Joback Calculated Property |
| η | [0.0000566; 0.0022382] | Pa×s | [395.72; 788.48] |
|
| η | 0.0022382 | Pa×s | 395.72 | Joback Calculated Property |
| η | 0.0007848 | Pa×s | 461.18 | Joback Calculated Property |
| η | 0.0003571 | Pa×s | 526.64 | Joback Calculated Property |
| η | 0.0001934 | Pa×s | 592.10 | Joback Calculated Property |
| η | 0.0001183 | Pa×s | 657.56 | Joback Calculated Property |
| η | 0.0000791 | Pa×s | 723.02 | Joback Calculated Property |
| η | 0.0000566 | Pa×s | 788.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, cyclopentyl dec-2-yl 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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