- InChI
- InChI=1S/C20H34O6/c21-19(25-15-17-9-7-13-23-17)11-5-3-1-2-4-6-12-20(22)26-16-18-10-8-14-24-18/h17-18H,1-16H2
- InChI Key
- RHWOXBBBVFKHAN-UHFFFAOYSA-N
- Formula
- C20H34O6
- SMILES
-
O=C(CCCCCCCCC(=O)OCC1CCCO1)OCC
1CCCO1 - Molecular Weight1
- 370.49
- 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).
- 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 | -1230.46 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 60.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 115.52 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 3.552 | Crippen Calculated Property | |
| McVol | 297.560 | ml/mol | McGowan Calculated Property |
| Inp | [2857.00; 2857.00] |
|
|
| Inp | 2857.00 | NIST | |
| Inp | 2857.00 | NIST | |
| Tboil | 671.75 | K | Relay (1.0) Calculated Property |
| Tfus | 295.77 | 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 | [1008.30; 1093.73] | J/mol×K | [858.10; 1061.87] |
|
| Cp,gas | 1008.30 | J/mol×K | 858.10 | Joback Calculated Property |
| Cp,gas | 1026.07 | J/mol×K | 892.06 | Joback Calculated Property |
| Cp,gas | 1042.37 | J/mol×K | 926.02 | Joback Calculated Property |
| Cp,gas | 1057.25 | J/mol×K | 959.99 | Joback Calculated Property |
| Cp,gas | 1070.74 | J/mol×K | 993.95 | Joback Calculated Property |
| Cp,gas | 1082.88 | J/mol×K | 1027.91 | Joback Calculated Property |
| Cp,gas | 1093.73 | J/mol×K | 1061.87 | Joback Calculated Property |
| η | [0.0000667; 0.0014180] | Pa×s | [474.76; 858.10] |
|
| η | 0.0014180 | Pa×s | 474.76 | Joback Calculated Property |
| η | 0.0006298 | Pa×s | 538.65 | Joback Calculated Property |
| η | 0.0003322 | Pa×s | 602.54 | Joback Calculated Property |
| η | 0.0001981 | Pa×s | 666.43 | Joback Calculated Property |
| η | 0.0001294 | Pa×s | 730.32 | Joback Calculated Property |
| η | 0.0000904 | Pa×s | 794.21 | Joback Calculated Property |
| η | 0.0000667 | Pa×s | 858.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, di(tetrahydrofurfuryl) 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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