- InChI
- InChI=1S/C6HBrCl4/c7-2-1-3(8)5(10)6(11)4(2)9/h1H
- InChI Key
- NEPMWYGBQGFJHN-UHFFFAOYSA-N
- Formula
- C6HBrCl4
- SMILES
- Clc1cc(Br)c(Cl)c(Cl)c1Cl
- Molecular Weight1
- 294.79
- CAS
- 1125-52-6
- 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).
- 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 | 0.4467 | Relay (1.0) Calculated Property | |
| ΔfG° | 40.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 36.45 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 25.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.92 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.95 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.03 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.063 | Crippen Calculated Property | |
| McVol | 138.100 | ml/mol | McGowan Calculated Property |
| Pc | 3896.50 | kPa | Joback Calculated Property |
| Tboil | 576.79 | K | Relay (1.0) Calculated Property |
| Tc | 829.43 | K | Relay (1.0) Calculated Property |
| Tfus | 363.86 | K | Relay (1.0) Calculated Property |
| Vc | 0.505 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [207.19; 231.75] | J/mol×K | [599.16; 860.80] | 
|
| Cp,gas | 207.19 | J/mol×K | 599.16 | Joback Calculated Property |
| Cp,gas | 212.24 | J/mol×K | 642.77 | Joback Calculated Property |
| Cp,gas | 216.87 | J/mol×K | 686.37 | Joback Calculated Property |
| Cp,gas | 221.11 | J/mol×K | 729.98 | Joback Calculated Property |
| Cp,gas | 224.98 | J/mol×K | 773.59 | Joback Calculated Property |
| Cp,gas | 228.52 | J/mol×K | 817.19 | Joback Calculated Property |
| Cp,gas | 231.75 | J/mol×K | 860.80 | Joback Calculated Property |
| η | [0.0002864; 0.0010054] | Pa×s | [413.36; 599.16] |
|
| η | 0.0010054 | Pa×s | 413.36 | Joback Calculated Property |
| η | 0.0007582 | Pa×s | 444.33 | Joback Calculated Property |
| η | 0.0005932 | Pa×s | 475.29 | Joback Calculated Property |
| η | 0.0004782 | Pa×s | 506.26 | Joback Calculated Property |
| η | 0.0003952 | Pa×s | 537.23 | Joback Calculated Property |
| η | 0.0003335 | Pa×s | 568.19 | Joback Calculated Property |
| η | 0.0002864 | Pa×s | 599.16 | Joback Calculated Property |
Similar Compounds
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Sources
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