- InChI
- InChI=1S/C6H2Cl4/c7-3-1-2-4(8)6(10)5(3)9/h1-2H
- InChI Key
- GBDZXPJXOMHESU-UHFFFAOYSA-N
- Formula
- C6H2Cl4
- SMILES
- Clc1ccc(Cl)c(Cl)c1Cl
- Molecular Weight1
- 215.89
- CAS
- 634-66-2
- Other Names
-
- 1,2,3,4-Tetrachlorobenzene
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,liquid : Liquid phase 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).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔsubH° : Enthalpy of sublimation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Ttriple : Triple Point Temperature (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 |
|---|---|---|---|
| ΔcH°solid | -2642.22 ± 0.74 | kJ/mol | NIST |
| ΔfG° | 35.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -25.40 | kJ/mol | NIST |
| ΔfusH° | 20.96 | kJ/mol | Joback Calculated Property |
| ΔsubH° | [60.84; 78.80] | kJ/mol |
|
| ΔsubH° | 78.80 ± 0.20 | kJ/mol | NIST |
| ΔsubH° | 60.84 | kJ/mol | NIST |
| ΔvapH° | 60.10 | kJ/mol | NIST |
| IE | [8.90; 9.23] | eV |
|
| IE | 8.90 | eV | NIST |
| IE | 9.23 ± 0.03 | eV | NIST |
| IE | 9.11 | eV | NIST |
| log10WS | [-4.63; -4.57] |
|
|
| log10WS | -4.63 | Aq. Sol... | |
| log10WS | -4.57 | Estimat... | |
| logPoct/wat | 4.300 | Crippen Calculated Property | |
| McVol | 120.600 | ml/mol | McGowan Calculated Property |
| Pc | 3646.53 | kPa | Joback Calculated Property |
| Inp | [219.20; 1411.00] |
|
|
| Inp | 1388.00 | NIST | |
| Inp | 1385.40 | NIST | |
| Inp | 1385.30 | NIST | |
| Inp | 1402.30 | NIST | |
| Inp | 1370.00 | NIST | |
| Inp | 1377.18 | NIST | |
| Inp | 1343.88 | NIST | |
| Inp | 1359.50 | NIST | |
| Inp | 1366.00 | NIST | |
| Inp | 1388.00 | NIST | |
| Inp | 1366.00 | NIST | |
| Inp | 1371.00 | NIST | |
| Inp | 1388.00 | NIST | |
| Inp | 1352.40 | NIST | |
| Inp | 1362.21 | NIST | |
| Inp | 1369.92 | NIST | |
| Inp | 1362.00 | NIST | |
| Inp | 1352.00 | NIST | |
| Inp | 1353.00 | NIST | |
| Inp | 1342.00 | NIST | |
| Inp | 1345.00 | NIST | |
| Inp | 1383.00 | NIST | |
| Inp | 1336.00 | NIST | |
| Inp | 1366.00 | NIST | |
| Inp | 1375.00 | NIST | |
| Inp | 1355.00 | NIST | |
| Inp | 1411.00 | NIST | |
| Inp | Outlier 237.00 | NIST | |
| Inp | Outlier 219.20 | NIST | |
| I | [1908.00; 1968.20] |
|
|
| I | 1914.10 | NIST | |
| I | 1938.00 | NIST | |
| I | 1968.20 | NIST | |
| I | 1908.00 | NIST | |
| I | 1941.00 | NIST | |
| I | 1951.96 | NIST | |
| I | 1931.77 | NIST | |
| I | 1944.44 | NIST | |
| I | 1920.95 | NIST | |
| I | 1914.10 | NIST | |
| Tboil | 527.20 | K | NIST |
| Tc | 774.01 | K | Joback Calculated Property |
| Tfus | [320.00; 320.40] | K |
|
| Tfus | 320.40 | K | Aq. Sol... |
| Tfus | 320.00 ± 0.20 | K | NIST |
| Ttriple | 319.68 ± 0.03 | K | NIST |
| Vc | 0.460 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [186.59; 217.36] | J/mol×K | [528.02; 774.01] |
|
| Cp,gas | 186.59 | J/mol×K | 528.02 | Joback Calculated Property |
| Cp,gas | 192.78 | J/mol×K | 569.02 | Joback Calculated Property |
| Cp,gas | 198.52 | J/mol×K | 610.02 | Joback Calculated Property |
| Cp,gas | 203.83 | J/mol×K | 651.01 | Joback Calculated Property |
| Cp,gas | 208.73 | J/mol×K | 692.01 | Joback Calculated Property |
| Cp,gas | 213.23 | J/mol×K | 733.01 | Joback Calculated Property |
| Cp,gas | 217.36 | J/mol×K | 774.01 | Joback Calculated Property |
| Cp,liquid | [225.17; 229.50] | J/mol×K | [327.15; 353.15] |
|
| Cp,liquid | 225.17 | J/mol×K | 327.15 | Heat Ca... |
| Cp,liquid | 225.49 | J/mol×K | 329.15 | Heat Ca... |
| Cp,liquid | 225.82 | J/mol×K | 331.15 | Heat Ca... |
| Cp,liquid | 226.14 | J/mol×K | 333.15 | Heat Ca... |
| Cp,liquid | 226.47 | J/mol×K | 335.15 | Heat Ca... |
| Cp,liquid | 226.80 | J/mol×K | 337.15 | Heat Ca... |
| Cp,liquid | 227.13 | J/mol×K | 339.15 | Heat Ca... |
| Cp,liquid | 227.46 | J/mol×K | 341.15 | Heat Ca... |
| Cp,liquid | 227.80 | J/mol×K | 343.15 | Heat Ca... |
| Cp,liquid | 228.13 | J/mol×K | 345.15 | Heat Ca... |
| Cp,liquid | 228.47 | J/mol×K | 347.15 | Heat Ca... |
| Cp,liquid | 228.81 | J/mol×K | 349.15 | Heat Ca... |
| Cp,liquid | 229.16 | J/mol×K | 351.15 | Heat Ca... |
| Cp,liquid | 229.50 | J/mol×K | 353.15 | Heat Ca... |
| η | [0.0003001; 0.0013389] | Pa×s | [341.04; 528.02] |
|
| η | 0.0013389 | Pa×s | 341.04 | Joback Calculated Property |
| η | 0.0009401 | Pa×s | 372.20 | Joback Calculated Property |
| η | 0.0006972 | Pa×s | 403.37 | Joback Calculated Property |
| η | 0.0005397 | Pa×s | 434.53 | Joback Calculated Property |
| η | 0.0004323 | Pa×s | 465.69 | Joback Calculated Property |
| η | 0.0003561 | Pa×s | 496.86 | Joback Calculated Property |
| η | 0.0003001 | Pa×s | 528.02 | Joback Calculated Property |
| ΔfusH | [16.96; 17.00] | kJ/mol | [319.68; 320.00] |
|
| ΔfusH | 16.96 | kJ/mol | 319.68 | NIST |
| ΔfusH | 17.00 | kJ/mol | 319.70 | NIST |
| ΔfusH | 17.00 | kJ/mol | 320.00 | NIST |
| ΔfusH | 17.00 | kJ/mol | 320.00 | NIST |
| ΔvapH | 56.70 | kJ/mol | 434.00 | NIST |
| ΔfusS | 53.10 | J/mol×K | 319.68 | NIST |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 527.20 | K | 101.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.65] | kPa | [387.40; 562.66] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.39017e+01 | |||
| Coefficient B | -4.07979e+03 | |||
| Coefficient C | -8.77250e+01 | |||
| Temperature range, min. | 387.40 | |||
| Temperature range, max. | 562.66 | |||
| Pvap | 1.33 | kPa | 387.40 | Calculated Property |
| Pvap | 3.06 | kPa | 406.87 | Calculated Property |
| Pvap | 6.38 | kPa | 426.35 | Calculated Property |
| Pvap | 12.29 | kPa | 445.82 | Calculated Property |
| Pvap | 22.11 | kPa | 465.29 | Calculated Property |
| Pvap | 37.57 | kPa | 484.77 | Calculated Property |
| Pvap | 60.74 | kPa | 504.24 | Calculated Property |
| Pvap | 94.08 | kPa | 523.71 | Calculated Property |
| Pvap | 140.36 | kPa | 543.19 | Calculated Property |
| Pvap | 202.65 | kPa | 562.66 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1,2,3,4-tetrachloro-.
Sources
- Crippen Method
- Heat Capacities and Densities of Some Liquid Chloro-, Bromo-, and Bromochloro-Substituted Benzenes
- Joback Method
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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