- InChI
- InChI=1S/C17H10Cl4O4/c18-11-3-1-10(2-4-11)9-24-15(22)5-6-16(23)25-17-13(20)7-12(19)8-14(17)21/h1-8H,9H2/b6-5+
- InChI Key
- DFLILAMCVZWJHV-AATRIKPKSA-N
- Formula
- C17H10Cl4O4
- SMILES
-
O=C(C=CC(=O)Oc1c(Cl)cc(Cl)cc1C
l)OCc1ccc(Cl)cc1 - Molecular Weight1
- 420.07
- 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° | -156.78 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -402.37 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 48.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.45 | kJ/mol | Joback Calculated Property |
| log10WS | -6.61 | Crippen Calculated Property | |
| logPoct/wat | 5.505 | Crippen Calculated Property | |
| McVol | 262.410 | ml/mol | McGowan Calculated Property |
| Pc | 1971.80 | kPa | Joback Calculated Property |
| Inp | [2922.00; 2922.00] |
|
|
| Inp | 2922.00 | NIST | |
| Inp | 2922.00 | NIST | |
| Tboil | 968.10 | K | Joback Calculated Property |
| Tc | 1219.35 | K | Joback Calculated Property |
| Tfus | 643.19 | K | Joback Calculated Property |
| Vc | 0.996 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [658.64; 690.47] | J/mol×K | [968.10; 1219.35] |
|
| Cp,gas | 658.64 | J/mol×K | 968.10 | Joback Calculated Property |
| Cp,gas | 666.47 | J/mol×K | 1009.98 | Joback Calculated Property |
| Cp,gas | 673.22 | J/mol×K | 1051.85 | Joback Calculated Property |
| Cp,gas | 678.96 | J/mol×K | 1093.73 | Joback Calculated Property |
| Cp,gas | 683.71 | J/mol×K | 1135.60 | Joback Calculated Property |
| Cp,gas | 687.54 | J/mol×K | 1177.48 | Joback Calculated Property |
| Cp,gas | 690.47 | J/mol×K | 1219.35 | Joback Calculated Property |
| η | [0.0000437; 0.0002289] | Pa×s | [643.19; 968.10] |
|
| η | 0.0002289 | Pa×s | 643.19 | Joback Calculated Property |
| η | 0.0001561 | Pa×s | 697.34 | Joback Calculated Property |
| η | 0.0001125 | Pa×s | 751.49 | Joback Calculated Property |
| η | 0.0000847 | Pa×s | 805.64 | Joback Calculated Property |
| η | 0.0000661 | Pa×s | 859.80 | Joback Calculated Property |
| η | 0.0000531 | Pa×s | 913.95 | Joback Calculated Property |
| η | 0.0000437 | Pa×s | 968.10 | Joback Calculated Property |
Similar Compounds
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Sources
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