- InChI
- InChI=1S/C8H5Cl2NS/c9-7-2-1-6(4-11-5-12)8(10)3-7/h1-3H,4H2
- InChI Key
- JZHPXEMPVDMDFB-UHFFFAOYSA-N
- Formula
- C8H5Cl2NS
- SMILES
- S=C=NCc1ccc(Cl)cc1Cl
- Molecular Weight1
- 218.10
- CAS
- 18967-41-4
- ΔfH°gas : Enthalpy of formation at standard conditions (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).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | 257.73 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.21 | kJ/mol | Joback Calculated Property |
| log10WS | -4.07 | Crippen Calculated Property | |
| logPoct/wat | 3.596 | Crippen Calculated Property | |
| McVol | 142.030 | ml/mol | McGowan Calculated Property |
| Pc | 3314.37 | kPa | Joback Calculated Property |
| Tboil | 639.89 | K | Joback Calculated Property |
| Tc | 908.27 | K | Joback Calculated Property |
Similar Compounds
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Sources
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