- InChI
- InChI=1S/C16H12Cl2O5/c17-11-1-5-13(6-2-11)22-15(19)9-21-10-16(20)23-14-7-3-12(18)4-8-14/h1-8H,9-10H2
- InChI Key
- VPBVMXXYCVXHJJ-UHFFFAOYSA-N
- Formula
- C16H12Cl2O5
- SMILES
-
O=C(COCC(=O)Oc1ccc(Cl)cc1)Oc1c
cc(Cl)cc1 - Molecular Weight1
- 355.17
- 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 | 0.8440 | Relay (1.0) Calculated Property | |
| ΔfG° | -307.30 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -689.12 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 39.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 113.00 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.18 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.94 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.521 | Crippen Calculated Property | |
| McVol | 234.010 | ml/mol | McGowan Calculated Property |
| Pc | 2222.89 | kPa | Joback Calculated Property |
| Inp | [3295.00; 3295.00] |
|
|
| Inp | 3295.00 | NIST | |
| Inp | 3295.00 | NIST | |
| Tboil | 667.32 | K | Relay (1.0) Calculated Property |
| Tc | 919.02 | K | Relay (1.0) Calculated Property |
| Tfus | 378.51 | K | Relay (1.0) Calculated Property |
| Vc | 0.834 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [624.97; 666.48] | J/mol×K | [878.66; 1117.38] |
|
| Cp,gas | 624.97 | J/mol×K | 878.66 | Joback Calculated Property |
| Cp,gas | 635.04 | J/mol×K | 918.45 | Joback Calculated Property |
| Cp,gas | 643.85 | J/mol×K | 958.23 | Joback Calculated Property |
| Cp,gas | 651.39 | J/mol×K | 998.02 | Joback Calculated Property |
| Cp,gas | 657.67 | J/mol×K | 1037.81 | Joback Calculated Property |
| Cp,gas | 662.70 | J/mol×K | 1077.59 | Joback Calculated Property |
| Cp,gas | 666.48 | J/mol×K | 1117.38 | Joback Calculated Property |
| η | [0.0000562; 0.0003394] | Pa×s | [574.35; 878.66] |
|
| η | 0.0003394 | Pa×s | 574.35 | Joback Calculated Property |
| η | 0.0002227 | Pa×s | 625.07 | Joback Calculated Property |
| η | 0.0001557 | Pa×s | 675.79 | Joback Calculated Property |
| η | 0.0001144 | Pa×s | 726.50 | Joback Calculated Property |
| η | 0.0000875 | Pa×s | 777.22 | Joback Calculated Property |
| η | 0.0000692 | Pa×s | 827.94 | Joback Calculated Property |
| η | 0.0000562 | Pa×s | 878.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, di(4-chlorophenyl) ester.
Sources
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