- InChI
- InChI=1S/C11H16Cl2O4/c1-2-3-4-7-16-10(14)5-6-11(15)17-8-9(12)13/h2,9H,1,3-8H2
- InChI Key
- RASHCYJVEYVRMP-UHFFFAOYSA-N
- Formula
- C11H16Cl2O4
- SMILES
- C=CCCCOC(=O)CCC(=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).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -832.46 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 36.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.14 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 2.623 | Crippen Calculated Property | |
| McVol | 200.910 | ml/mol | McGowan Calculated Property |
| Inp | [1802.00; 1802.00] |
|
|
| Inp | 1802.00 | NIST | |
| Inp | 1802.00 | NIST | |
| Tboil | 579.46 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Normal melting (fusion) point, 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.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [288.19; 591.62] | 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 | 6.48160e+01 | |||
| Coefficient B | 9.38700e-01 | |||
| Coefficient C | -4.52300e-04 | |||
| Coefficient D | 4.04000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 288.19 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 342.09 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 390.64 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 433.97 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 472.22 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 505.51 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 533.96 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 557.71 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 576.89 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 591.62 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0031647; 0.0001684] | Pa×s | [341.47; 579.12] |
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 | -1.29040e+01 | |||
| Coefficient B | 2.44094e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 341.47 | |||
| Temperature range, max. | 579.12 | |||
| η | 0.0031647 | Pa×s | 341.47 | Calculated Property |
| η | 0.0018945 | Pa×s | 367.88 | Calculated Property |
| η | 0.0012148 | Pa×s | 394.28 | Calculated Property |
| η | 0.0008237 | Pa×s | 420.69 | Calculated Property |
| η | 0.0005847 | Pa×s | 447.09 | Calculated Property |
| η | 0.0004312 | Pa×s | 473.50 | Calculated Property |
| η | 0.0003284 | Pa×s | 499.90 | Calculated Property |
| η | 0.0002571 | Pa×s | 526.31 | Calculated Property |
| η | 0.0002060 | Pa×s | 552.72 | Calculated Property |
| η | 0.0001684 | Pa×s | 579.12 | Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2,2-dichloroethyl pent-4-en-1-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
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