- InChI
- InChI=1S/C12HCl9/c13-2-1-3(14)7(16)4(6(2)15)5-8(17)10(19)12(21)11(20)9(5)18/h1H
- InChI Key
- XIFFTDRFWYFAPO-UHFFFAOYSA-N
- Formula
- C12HCl9
- SMILES
-
Clc1cc(Cl)c(Cl)c(-c2c(Cl)c(Cl)
c(Cl)c(Cl)c2Cl)c1Cl - Molecular Weight1
- 464.21
- CAS
- 52663-77-1
- Other Names
-
- 1,2,3,4,5-pentachloro-6-(2,3,5,6-tetrachlorophenyl)benzene
- 2,2',3,3',4,5,5',6,6'-Nonachlorobiphenyl
- PCB 208
- 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).
- ΔfusH : Enthalpy of fusion at a given temperature (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° | 80.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -62.84 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 49.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.28 | kJ/mol | Joback Calculated Property |
| log10WS | -10.41 | Aq. Sol... | |
| logPoct/wat | 9.234 | Crippen Calculated Property | |
| McVol | 242.580 | ml/mol | McGowan Calculated Property |
| Pc | 2111.94 | kPa | Joback Calculated Property |
| Inp | 2597.00 | NIST | |
| Tboil | 909.01 | K | Joback Calculated Property |
| Tc | 1184.69 | K | Joback Calculated Property |
| Tfus | 659.80 | K | Joback Calculated Property |
| Vc | 0.932 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [439.23; 459.52] | J/mol×K | [909.01; 1184.69] | 
|
| Cp,gas | 439.23 | J/mol×K | 909.01 | Joback Calculated Property |
| Cp,gas | 444.21 | J/mol×K | 954.96 | Joback Calculated Property |
| Cp,gas | 448.52 | J/mol×K | 1000.90 | Joback Calculated Property |
| Cp,gas | 452.18 | J/mol×K | 1046.85 | Joback Calculated Property |
| Cp,gas | 455.22 | J/mol×K | 1092.79 | Joback Calculated Property |
| Cp,gas | 457.66 | J/mol×K | 1138.74 | Joback Calculated Property |
| Cp,gas | 459.52 | J/mol×K | 1184.69 | Joback Calculated Property |
| η | [0.0000999; 0.0002929] | Pa×s | [659.80; 909.01] |
|
| η | 0.0002929 | Pa×s | 659.80 | Joback Calculated Property |
| η | 0.0002322 | Pa×s | 701.34 | Joback Calculated Property |
| η | 0.0001889 | Pa×s | 742.87 | Joback Calculated Property |
| η | 0.0001571 | Pa×s | 784.40 | Joback Calculated Property |
| η | 0.0001331 | Pa×s | 825.94 | Joback Calculated Property |
| η | 0.0001145 | Pa×s | 867.48 | Joback Calculated Property |
| η | 0.0000999 | Pa×s | 909.01 | Joback Calculated Property |
| ΔfusH | 22.60 | kJ/mol | 455.80 | NIST |
Similar Compounds
Find more compounds similar to 1,1'-Biphenyl, 2,2',3,3',4,5,5',6,6'-nonachloro-.
Sources
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