- InChI
- InChI=1S/C18H30O6/c1-11(2)13(19)17(5,6)15(21)23-9-10-24-16(22)18(7,8)14(20)12(3)4/h11-12H,9-10H2,1-8H3
- InChI Key
- BEGGHCFDNUXHDL-UHFFFAOYSA-N
- Formula
- C18H30O6
- SMILES
-
CC(C)C(=O)C(C)(C)C(=O)OCCOC(=O
)C(C)(C)C(=O)C(C)C - Molecular Weight1
- 342.43
- 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).
- 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 | -1278.63 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 32.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.85 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.85 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 2.575 | Crippen Calculated Property | |
| McVol | 282.500 | ml/mol | McGowan Calculated Property |
| Tboil | 561.11 | K | Relay (1.0) Calculated Property |
| Tfus | 354.78 | 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 | [881.62; 954.76] | J/mol×K | [828.28; 1030.30] | 
|
| Cp,gas | 881.62 | J/mol×K | 828.28 | Joback Calculated Property |
| Cp,gas | 896.63 | J/mol×K | 861.95 | Joback Calculated Property |
| Cp,gas | 910.45 | J/mol×K | 895.62 | Joback Calculated Property |
| Cp,gas | 923.13 | J/mol×K | 929.29 | Joback Calculated Property |
| Cp,gas | 934.70 | J/mol×K | 962.96 | Joback Calculated Property |
| Cp,gas | 945.23 | J/mol×K | 996.63 | Joback Calculated Property |
| Cp,gas | 954.76 | J/mol×K | 1030.30 | Joback Calculated Property |
| η | [0.0000267; 0.0012588] | Pa×s | [451.98; 828.28] |
|
| η | 0.0012588 | Pa×s | 451.98 | Joback Calculated Property |
| η | 0.0004478 | Pa×s | 514.70 | Joback Calculated Property |
| η | 0.0001994 | Pa×s | 577.41 | Joback Calculated Property |
| η | 0.0001040 | Pa×s | 640.13 | Joback Calculated Property |
| η | 0.0000610 | Pa×s | 702.85 | Joback Calculated Property |
| η | 0.0000390 | Pa×s | 765.56 | Joback Calculated Property |
| η | 0.0000267 | Pa×s | 828.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethylene glycol bis(2,2,4-trimethyl-3-oxovalerate).
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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