- InChI
- InChI=1S/C9H14Cl2O5/c1-14-4-5-15-8(12)2-3-9(13)16-6-7(10)11/h7H,2-6H2,1H3
- InChI Key
- FOKMUTWPOVCIHE-UHFFFAOYSA-N
- Formula
- C9H14Cl2O5
- SMILES
- COCCOC(=O)CCC(=O)OCC(Cl)Cl
- Molecular Weight1
- 273.11
- 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.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -997.79 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 33.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.72 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 1.303 | Crippen Calculated Property | |
| McVol | 182.900 | ml/mol | McGowan Calculated Property |
| Inp | [1727.00; 1727.00] |
|
|
| Inp | 1727.00 | NIST | |
| Inp | 1727.00 | NIST | |
| Tboil | 566.27 | K | Relay (1.0) Calculated Property |
| Tc | 745.74 | K | Relay (1.0) Calculated Property |
| Tfus | 284.59 | 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.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [270.98; 535.45] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 9.51250e+01 | |||
| Coefficient B | 7.05520e-01 | |||
| Coefficient C | -2.09600e-04 | |||
| Coefficient D | -5.56000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 270.98 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 316.03 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 357.57 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 395.43 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 429.43 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 459.41 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 485.17 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 506.55 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 523.36 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 535.44 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0026055; 0.0001592] | Pa×s | [342.92; 564.85] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.30651e+01 | |||
| Coefficient B | 2.43987e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 342.92 | |||
| Temperature range, max. | 564.85 | |||
| η | 0.0026055 | Pa×s | 342.92 | Calculated Property |
| η | 0.0016166 | Pa×s | 367.58 | Calculated Property |
| η | 0.0010650 | Pa×s | 392.24 | Calculated Property |
| η | 0.0007372 | Pa×s | 416.90 | Calculated Property |
| η | 0.0005317 | Pa×s | 441.56 | Calculated Property |
| η | 0.0003969 | Pa×s | 466.22 | Calculated Property |
| η | 0.0003052 | Pa×s | 490.88 | Calculated Property |
| η | 0.0002406 | Pa×s | 515.53 | Calculated Property |
| η | 0.0001938 | Pa×s | 540.19 | Calculated Property |
| η | 0.0001592 | Pa×s | 564.85 | Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2,2-dichloroethyl 2-methoxyethyl 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
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