- InChI
- InChI=1S/C12H3Cl7O/c13-4-1-2-6(10(17)8(4)15)20-7-3-5(14)9(16)12(19)11(7)18/h1-3H
- InChI Key
- BLBURLWSCHSPIS-UHFFFAOYSA-N
- Formula
- C12H3Cl7O
- SMILES
-
Clc1ccc(Oc2cc(Cl)c(Cl)c(Cl)c2C
l)c(Cl)c1Cl - Molecular Weight1
- 411.33
- 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).
- 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° | 19.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -140.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.60 | kJ/mol | Joback Calculated Property |
| log10WS | -9.12 | Aq. Sol... | |
| logPoct/wat | 8.053 | Crippen Calculated Property | |
| McVol | 223.970 | ml/mol | McGowan Calculated Property |
| Pc | 2291.52 | kPa | Joback Calculated Property |
| Tboil | 846.61 | K | Joback Calculated Property |
| Tc | 1114.35 | K | Joback Calculated Property |
| Tfus | 597.15 | K | Joback Calculated Property |
| Vc | 0.853 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [436.95; 464.76] | J/mol×K | [846.61; 1114.35] | 
|
| Cp,gas | 436.95 | J/mol×K | 846.61 | Joback Calculated Property |
| Cp,gas | 443.65 | J/mol×K | 891.23 | Joback Calculated Property |
| Cp,gas | 449.51 | J/mol×K | 935.86 | Joback Calculated Property |
| Cp,gas | 454.54 | J/mol×K | 980.48 | Joback Calculated Property |
| Cp,gas | 458.75 | J/mol×K | 1025.10 | Joback Calculated Property |
| Cp,gas | 462.15 | J/mol×K | 1069.73 | Joback Calculated Property |
| Cp,gas | 464.76 | J/mol×K | 1114.35 | Joback Calculated Property |
| η | [0.0000964; 0.0003259] | Pa×s | [597.15; 846.61] |
|
| η | 0.0003259 | Pa×s | 597.15 | Joback Calculated Property |
| η | 0.0002490 | Pa×s | 638.73 | Joback Calculated Property |
| η | 0.0001966 | Pa×s | 680.30 | Joback Calculated Property |
| η | 0.0001595 | Pa×s | 721.88 | Joback Calculated Property |
| η | 0.0001324 | Pa×s | 763.46 | Joback Calculated Property |
| η | 0.0001120 | Pa×s | 805.03 | Joback Calculated Property |
| η | 0.0000964 | Pa×s | 846.61 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,2',3,3',4,4',5-Heptachlorodiphenyl ether.
Sources
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