- InChI
- InChI=1S/C12H12Cl2O5/c1-2-18-10(15)6-17-7-11(16)19-9-5-3-4-8(13)12(9)14/h3-5H,2,6-7H2,1H3
- InChI Key
- AOQJXIWCPYFGGN-UHFFFAOYSA-N
- Formula
- C12H12Cl2O5
- SMILES
-
CCOC(=O)COCC(=O)Oc1cccc(Cl)c1C
l - Molecular Weight1
- 307.13
- 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 | 0.7632 | Relay (1.0) Calculated Property | |
| ΔfG° | -453.39 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -841.02 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 35.25 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.82 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.50 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.44 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.478 | Crippen Calculated Property | |
| McVol | 201.410 | ml/mol | McGowan Calculated Property |
| Pc | 2338.29 | kPa | Joback Calculated Property |
| Inp | [2558.00; 2558.00] |
|
|
| Inp | 2558.00 | NIST | |
| Inp | 2558.00 | NIST | |
| Tboil | 610.48 | K | Relay (1.0) Calculated Property |
| Tc | 830.23 | K | Relay (1.0) Calculated Property |
| Tfus | 318.78 | K | Relay (1.0) Calculated Property |
| Vc | 0.734 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [507.79; 560.32] | J/mol×K | [760.46; 977.36] |
|
| Cp,gas | 507.79 | J/mol×K | 760.46 | Joback Calculated Property |
| Cp,gas | 518.77 | J/mol×K | 796.61 | Joback Calculated Property |
| Cp,gas | 528.89 | J/mol×K | 832.76 | Joback Calculated Property |
| Cp,gas | 538.12 | J/mol×K | 868.91 | Joback Calculated Property |
| Cp,gas | 546.45 | J/mol×K | 905.06 | Joback Calculated Property |
| Cp,gas | 553.85 | J/mol×K | 941.21 | Joback Calculated Property |
| Cp,gas | 560.32 | J/mol×K | 977.36 | Joback Calculated Property |
| η | [0.0000948; 0.0005363] | Pa×s | [502.85; 760.46] |
|
| η | 0.0005363 | Pa×s | 502.85 | Joback Calculated Property |
| η | 0.0003586 | Pa×s | 545.79 | Joback Calculated Property |
| η | 0.0002543 | Pa×s | 588.72 | Joback Calculated Property |
| η | 0.0001890 | Pa×s | 631.65 | Joback Calculated Property |
| η | 0.0001458 | Pa×s | 674.59 | Joback Calculated Property |
| η | 0.0001161 | Pa×s | 717.53 | Joback Calculated Property |
| η | 0.0000948 | Pa×s | 760.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, 2,3-dichlorophenyl ethyl ester.
Sources
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