- InChI
- InChI=1S/C12H8Cl2S/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H
- InChI Key
- MJEPOVIWHVRBIT-UHFFFAOYSA-N
- Formula
- C12H8Cl2S
- SMILES
- Clc1ccc(Sc2ccc(Cl)cc2)cc1
- Molecular Weight1
- 255.16
- CAS
- 5181-10-2
- Other Names
-
- Sulfide, bis(p-chlorophenyl)
- p-Chlorophenyl sulfide
- Bis(p-chlorophenyl) sulfide
- Bis(4-chlorophenyl) sulfide
- Di-p-chlorophenyl sulfide
- 4,4'-Dichlorodiphenyl sulfide
- Benzene, 1,1'-thiobis(4-chloro-
- 4-Chlorophenyl sulfide
- NSC 40470
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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 | 0.4033 | Relay (1.0) Calculated Property | |
| ΔfG° | 264.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 146.52 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 26.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.55 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.15 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.73 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.145 | Crippen Calculated Property | |
| McVol | 173.250 | ml/mol | McGowan Calculated Property |
| Pc | 3103.64 | kPa | Joback Calculated Property |
| Tboil | 623.64 | K | Relay (1.0) Calculated Property |
| Tc | 840.36 | K | Relay (1.0) Calculated Property |
| Tfus | 384.55 | K | Relay (1.0) Calculated Property |
| Vc | 0.612 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [374.16; 432.82] | J/mol×K | [680.92; 959.03] | 
|
| Cp,gas | 374.16 | J/mol×K | 680.92 | Joback Calculated Property |
| Cp,gas | 386.80 | J/mol×K | 727.27 | Joback Calculated Property |
| Cp,gas | 398.19 | J/mol×K | 773.62 | Joback Calculated Property |
| Cp,gas | 408.42 | J/mol×K | 819.98 | Joback Calculated Property |
| Cp,gas | 417.55 | J/mol×K | 866.33 | Joback Calculated Property |
| Cp,gas | 425.66 | J/mol×K | 912.68 | Joback Calculated Property |
| Cp,gas | 432.82 | J/mol×K | 959.03 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4,4'-Dichlorodiphenylsulphide.
Sources
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