- InChI
- InChI=1S/C11H16Cl2O4/c1-3-8(2)17-11(15)6-4-5-10(14)16-7-9(12)13/h3,8-9H,1,4-7H2,2H3
- InChI Key
- GLETVGMXLXJBAE-UHFFFAOYSA-N
- Formula
- C11H16Cl2O4
- SMILES
- C=CC(C)OC(=O)CCCC(=O)OCC(Cl)Cl
- Molecular Weight1
- 283.15
- 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).
- Tc : Critical 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 | -848.92 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 33.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.89 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 2.621 | Crippen Calculated Property | |
| McVol | 200.910 | ml/mol | McGowan Calculated Property |
| Inp | [1698.00; 1698.00] |
|
|
| Inp | 1698.00 | NIST | |
| Inp | 1698.00 | NIST | |
| Tboil | 557.40 | K | Relay (1.0) Calculated Property |
| Tc | 733.36 | K | Relay (1.0) Calculated Property |
| Tfus | 280.56 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate 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 | [490.91; 556.22] | J/mol×K | [638.38; 830.12] |
|
| Cp,gas | 490.91 | J/mol×K | 638.38 | Joback Calculated Property |
| Cp,gas | 503.69 | J/mol×K | 670.34 | Joback Calculated Property |
| Cp,gas | 515.70 | J/mol×K | 702.29 | Joback Calculated Property |
| Cp,gas | 526.95 | J/mol×K | 734.25 | Joback Calculated Property |
| Cp,gas | 537.44 | J/mol×K | 766.21 | Joback Calculated Property |
| Cp,gas | 547.20 | J/mol×K | 798.16 | Joback Calculated Property |
| Cp,gas | 556.22 | J/mol×K | 830.12 | Joback Calculated Property |
| η | [0.0001057; 0.0043161] | Pa×s | [326.47; 638.38] |
|
| η | 0.0043161 | Pa×s | 326.47 | Joback Calculated Property |
| η | 0.0015211 | Pa×s | 378.45 | Joback Calculated Property |
| η | 0.0006896 | Pa×s | 430.44 | Joback Calculated Property |
| η | 0.0003708 | Pa×s | 482.42 | Joback Calculated Property |
| η | 0.0002249 | Pa×s | 534.41 | Joback Calculated Property |
| η | 0.0001491 | Pa×s | 586.39 | Joback Calculated Property |
| η | 0.0001057 | Pa×s | 638.38 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, but-3-en-2-yl 2,2-dichloroethyl 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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