- InChI
- InChI=1S/C12H4Cl6N2/c13-5-1-9(17)11(3-7(5)15)19-20-12-4-8(16)6(14)2-10(12)18/h1-4H/b20-19+
- InChI Key
- SMDPHUIHCPMCKV-FMQUCBEESA-N
- Formula
- C12H4Cl6N2
- SMILES
-
Clc1cc(Cl)c(N=Nc2cc(Cl)c(Cl)cc
2Cl)cc1Cl - Molecular Weight1
- 388.89
- CAS
- 25016-08-4
- 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 | 66.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.81 | kJ/mol | Joback Calculated Property |
| log10WS | -7.62 | Crippen Calculated Property | |
| logPoct/wat | 8.022 | Crippen Calculated Property | |
| McVol | 221.520 | ml/mol | McGowan Calculated Property |
| Pc | 1920.30 | kPa | Joback Calculated Property |
| Tboil | 930.98 | K | Joback Calculated Property |
| Tc | 1212.48 | K | Joback Calculated Property |
Similar Compounds
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Sources
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