- InChI
- InChI=1S/C9H7Cl4NO/c1-9(12,13)8(15)14-5-2-3-6(10)7(11)4-5/h2-4H,1H3,(H,14,15)
- InChI Key
- YGRDEBCXIKCCIA-UHFFFAOYSA-N
- Formula
- C9H7Cl4NO
- SMILES
-
CC(Cl)(Cl)C(=O)Nc1ccc(Cl)c(Cl)
c1 - Molecular Weight1
- 286.97
- CAS
- 37995-08-7
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 33.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -146.32 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.65 | kJ/mol | Joback Calculated Property |
| log10WS | -4.38 | Crippen Calculated Property | |
| logPoct/wat | 4.126 | Crippen Calculated Property | |
| McVol | 174.420 | ml/mol | McGowan Calculated Property |
| Pc | 2973.04 | kPa | Joback Calculated Property |
| Tboil | 692.49 | K | Joback Calculated Property |
| Tc | 941.20 | K | Joback Calculated Property |
| Tfus | 467.34 | K | Joback Calculated Property |
| Vc | 0.657 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [369.85; 412.49] | J/mol×K | [692.49; 941.20] | 
|
| Cp,gas | 369.85 | J/mol×K | 692.49 | Joback Calculated Property |
| Cp,gas | 378.83 | J/mol×K | 733.94 | Joback Calculated Property |
| Cp,gas | 386.95 | J/mol×K | 775.39 | Joback Calculated Property |
| Cp,gas | 394.31 | J/mol×K | 816.85 | Joback Calculated Property |
| Cp,gas | 400.96 | J/mol×K | 858.30 | Joback Calculated Property |
| Cp,gas | 406.99 | J/mol×K | 899.75 | Joback Calculated Property |
| Cp,gas | 412.49 | J/mol×K | 941.20 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,2,3',4'-Tetrachloropropionanilide.
Sources
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