- InChI
- InChI=1S/C19H16Cl4O4/c20-14-6-4-12(16(22)8-14)10-26-18(24)2-1-3-19(25)27-11-13-5-7-15(21)9-17(13)23/h4-9H,1-3,10-11H2
- InChI Key
- FFQTUPGMCAVAGB-UHFFFAOYSA-N
- Formula
- C19H16Cl4O4
- SMILES
-
O=C(CCCC(=O)OCc1ccc(Cl)cc1Cl)O
Cc1ccc(Cl)cc1Cl - Molecular Weight1
- 450.14
- 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° | -220.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -560.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 53.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.94 | kJ/mol | Joback Calculated Property |
| log10WS | -7.44 | Crippen Calculated Property | |
| logPoct/wat | 6.257 | Crippen Calculated Property | |
| McVol | 294.890 | ml/mol | McGowan Calculated Property |
| Pc | 1605.13 | kPa | Joback Calculated Property |
| Inp | [3242.00; 3242.00] |
|
|
| Inp | 3242.00 | NIST | |
| Inp | 3242.00 | NIST | |
| Tboil | 1009.70 | K | Joback Calculated Property |
| Tc | 1251.92 | K | Joback Calculated Property |
| Tfus | 670.81 | K | Joback Calculated Property |
| Vc | 1.127 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [800.65; 831.86] | J/mol×K | [1009.70; 1251.92] |
|
| Cp,gas | 800.65 | J/mol×K | 1009.70 | Joback Calculated Property |
| Cp,gas | 808.94 | J/mol×K | 1050.07 | Joback Calculated Property |
| Cp,gas | 815.96 | J/mol×K | 1090.44 | Joback Calculated Property |
| Cp,gas | 821.73 | J/mol×K | 1130.81 | Joback Calculated Property |
| Cp,gas | 826.28 | J/mol×K | 1171.18 | Joback Calculated Property |
| Cp,gas | 829.65 | J/mol×K | 1211.55 | Joback Calculated Property |
| Cp,gas | 831.86 | J/mol×K | 1251.92 | Joback Calculated Property |
| η | [0.0000370; 0.0002010] | Pa×s | [670.81; 1009.70] |
|
| η | 0.0002010 | Pa×s | 670.81 | Joback Calculated Property |
| η | 0.0001359 | Pa×s | 727.29 | Joback Calculated Property |
| η | 0.0000972 | Pa×s | 783.77 | Joback Calculated Property |
| η | 0.0000727 | Pa×s | 840.26 | Joback Calculated Property |
| η | 0.0000564 | Pa×s | 896.74 | Joback Calculated Property |
| η | 0.0000451 | Pa×s | 953.22 | Joback Calculated Property |
| η | 0.0000370 | Pa×s | 1009.70 | Joback Calculated Property |
Similar Compounds
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Sources
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