- InChI
- InChI=1S/C4H6Cl4/c5-1-3(7)4(8)2-6/h3-4H,1-2H2
- InChI Key
- IXZVKECRTHXEEW-UHFFFAOYSA-N
- Formula
- C4H6Cl4
- SMILES
- ClCC(Cl)C(Cl)CCl
- Molecular Weight1
- 195.90
- CAS
- 3405-32-1
- ω : Acentric Factor.
- 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).
- 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).
- 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 |
|---|---|---|---|
| ω | 0.3643 | Relay (1.0) Calculated Property | |
| ΔfG° | -69.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -228.50 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 15.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.42 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.50 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.00 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.679 | Crippen Calculated Property | |
| McVol | 116.180 | ml/mol | McGowan Calculated Property |
| Pc | 3325.84 | kPa | Joback Calculated Property |
| Tboil | 471.47 | K | Relay (1.0) Calculated Property |
| Tc | 703.72 | K | Relay (1.0) Calculated Property |
| Tfus | 318.35 | K | Relay (1.0) Calculated Property |
| Vc | 0.407 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [143.33; 259.85] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 4.74520e+01 | |||
| Coefficient B | 4.22800e-01 | |||
| Coefficient C | -2.81800e-04 | |||
| Coefficient D | 7.14000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 143.33 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 164.92 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 183.83 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 200.27 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 214.48 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 226.67 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 237.08 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 245.93 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 253.44 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 259.85 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0086080; 0.0003330] | Pa×s | [224.52; 452.91] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.12044e+01 | |||
| Coefficient B | 1.44800e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 224.52 | |||
| Temperature range, max. | 452.91 | |||
| η | 0.0086080 | Pa×s | 224.52 | Calculated Property |
| η | 0.0044717 | Pa×s | 249.90 | Calculated Property |
| η | 0.0026211 | Pa×s | 275.27 | Calculated Property |
| η | 0.0016813 | Pa×s | 300.65 | Calculated Property |
| η | 0.0011557 | Pa×s | 326.03 | Calculated Property |
| η | 0.0008386 | Pa×s | 351.41 | Calculated Property |
| η | 0.0006354 | Pa×s | 376.78 | Calculated Property |
| η | 0.0004985 | Pa×s | 402.16 | Calculated Property |
| η | 0.0004026 | Pa×s | 427.54 | Calculated Property |
| η | 0.0003330 | Pa×s | 452.91 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.65] | kPa | [338.22; 496.08] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.39423e+01 | |||
| Coefficient B | -3.70313e+03 | |||
| Coefficient C | -6.70210e+01 | |||
| Temperature range, min. | 338.22 | |||
| Temperature range, max. | 496.08 | |||
| Pvap | 1.33 | kPa | 338.22 | Calculated Property |
| Pvap | 3.06 | kPa | 355.76 | Calculated Property |
| Pvap | 6.37 | kPa | 373.30 | Calculated Property |
| Pvap | 12.26 | kPa | 390.84 | Calculated Property |
| Pvap | 22.07 | kPa | 408.38 | Calculated Property |
| Pvap | 37.50 | kPa | 425.92 | Calculated Property |
| Pvap | 60.64 | kPa | 443.46 | Calculated Property |
| Pvap | 93.97 | kPa | 461.00 | Calculated Property |
| Pvap | 140.27 | kPa | 478.54 | Calculated Property |
| Pvap | 202.65 | kPa | 496.08 | Calculated Property |
Similar Compounds
Find more compounds similar to 1,2,3,4-tetrachlorobutane.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- The Yaws Handbook of Vapor Pressure
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