- InChI
- InChI=1S/C8H12Cl2O4/c1-2-13-7(11)3-4-8(12)14-5-6(9)10/h6H,2-5H2,1H3
- InChI Key
- PFNFXPLZQOXXMK-UHFFFAOYSA-N
- Formula
- C8H12Cl2O4
- SMILES
- CCOC(=O)CCC(=O)OCC(Cl)Cl
- Molecular Weight1
- 243.09
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- 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).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.6271 | Relay (1.0) Calculated Property | |
| ΔfG° | -630.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -870.79 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 30.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.35 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.44 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.677 | Crippen Calculated Property | |
| McVol | 162.940 | ml/mol | McGowan Calculated Property |
| Pc | 2398.22 | kPa | Joback Calculated Property |
| Inp | [1506.00; 1506.00] |
|
|
| Inp | 1506.00 | NIST | |
| Inp | 1506.00 | NIST | |
| Tboil | 533.37 | K | Relay (1.0) Calculated Property |
| Tc | 716.76 | K | Relay (1.0) Calculated Property |
| Tfus | 278.56 | K | Relay (1.0) Calculated Property |
| Vc | 0.606 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [234.36; 465.35] | 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 | 7.05340e+01 | |||
| Coefficient B | 6.73720e-01 | |||
| Coefficient C | -2.66200e-04 | |||
| Coefficient D | -1.27000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 234.36 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 275.00 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 311.99 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 345.29 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 374.86 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 400.66 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 422.65 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 440.79 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 455.04 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 465.35 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0044709; 0.0002151] | Pa×s | [309.42; 535.54] |
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 | -1.25966e+01 | |||
| Coefficient B | 2.22362e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 309.42 | |||
| Temperature range, max. | 535.54 | |||
| η | 0.0044709 | Pa×s | 309.42 | Calculated Property |
| η | 0.0026062 | Pa×s | 334.54 | Calculated Property |
| η | 0.0016382 | Pa×s | 359.67 | Calculated Property |
| η | 0.0010941 | Pa×s | 384.79 | Calculated Property |
| η | 0.0007678 | Pa×s | 409.92 | Calculated Property |
| η | 0.0005613 | Pa×s | 435.04 | Calculated Property |
| η | 0.0004246 | Pa×s | 460.16 | Calculated Property |
| η | 0.0003306 | Pa×s | 485.29 | Calculated Property |
| η | 0.0002639 | Pa×s | 510.41 | Calculated Property |
| η | 0.0002151 | Pa×s | 535.54 | Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2,2-dichloroethyl ethyl ester.
Sources
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