- InChI
- InChI=1S/C26H32Cl2O6/c1-31-23-15-21(27)13-11-19(23)17-33-25(29)9-7-5-3-4-6-8-10-26(30)34-18-20-12-14-22(28)16-24(20)32-2/h11-16H,3-10,17-18H2,1-2H3
- InChI Key
- ZSQLJMMLGNWAAA-UHFFFAOYSA-N
- Formula
- C26H32Cl2O6
- SMILES
-
COc1cc(Cl)ccc1COC(=O)CCCCCCCCC
(=O)OCc1ccc(Cl)cc1OC - Molecular Weight1
- 511.44
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -347.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -938.31 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 65.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 112.57 | kJ/mol | Joback Calculated Property |
| log10WS | -8.40 | Crippen Calculated Property | |
| logPoct/wat | 6.918 | Crippen Calculated Property | |
| McVol | 380.780 | ml/mol | McGowan Calculated Property |
| Pc | 1022.04 | kPa | Joback Calculated Property |
| Inp | [3610.00; 3610.00] |
|
|
| Inp | 3610.00 | NIST | |
| Inp | 3610.00 | NIST | |
| Tboil | 1139.84 | K | Joback Calculated Property |
| Tc | 1397.45 | K | Joback Calculated Property |
| Tfus | 734.32 | K | Joback Calculated Property |
| Vc | 1.458 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1221.25; 1237.61] | J/mol×K | [1139.84; 1397.45] |
|
| Cp,gas | 1221.25 | J/mol×K | 1139.84 | Joback Calculated Property |
| Cp,gas | 1228.85 | J/mol×K | 1182.78 | Joback Calculated Property |
| Cp,gas | 1234.10 | J/mol×K | 1225.71 | Joback Calculated Property |
| Cp,gas | 1237.01 | J/mol×K | 1268.65 | Joback Calculated Property |
| Cp,gas | 1237.61 | J/mol×K | 1311.58 | Joback Calculated Property |
| Cp,gas | 1235.91 | J/mol×K | 1354.52 | Joback Calculated Property |
| Cp,gas | 1231.91 | J/mol×K | 1397.45 | Joback Calculated Property |
| η | [0.0000097; 0.0000655] | Pa×s | [734.32; 1139.84] |
|
| η | 0.0000655 | Pa×s | 734.32 | Joback Calculated Property |
| η | 0.0000416 | Pa×s | 801.91 | Joback Calculated Property |
| η | 0.0000284 | Pa×s | 869.49 | Joback Calculated Property |
| η | 0.0000205 | Pa×s | 937.08 | Joback Calculated Property |
| η | 0.0000154 | Pa×s | 1004.67 | Joback Calculated Property |
| η | 0.0000120 | Pa×s | 1072.25 | Joback Calculated Property |
| η | 0.0000097 | Pa×s | 1139.84 | Joback Calculated Property |
Similar Compounds
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Sources
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