- InChI
- InChI=1S/C8H5Cl4NO/c9-5-2-1-3-6(4-5)13-7(14)8(10,11)12/h1-4H,(H,13,14)
- InChI Key
- ZCNFWVGKVHRKCD-UHFFFAOYSA-N
- Formula
- C8H5Cl4NO
- SMILES
- O=C(Nc1cccc(Cl)c1)C(Cl)(Cl)Cl
- Molecular Weight1
- 272.94
- 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).
- 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° | 34.85 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -114.21 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.77 | kJ/mol | Joback Calculated Property |
| log10WS | -3.92 | Crippen Calculated Property | |
| logPoct/wat | 3.649 | Crippen Calculated Property | |
| McVol | 160.330 | ml/mol | McGowan Calculated Property |
| Pc | 3368.44 | kPa | Joback Calculated Property |
| Inp | [1781.00; 1781.00] |
|
|
| Inp | 1781.00 | NIST | |
| Inp | 1781.00 | NIST | |
| Tboil | 664.63 | K | Joback Calculated Property |
| Tc | 918.20 | K | Joback Calculated Property |
| Tfus | 443.55 | K | Joback Calculated Property |
| Vc | 0.602 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [324.54; 362.90] | J/mol×K | [664.63; 918.20] |
|
| Cp,gas | 324.54 | J/mol×K | 664.63 | Joback Calculated Property |
| Cp,gas | 332.85 | J/mol×K | 706.89 | Joback Calculated Property |
| Cp,gas | 340.28 | J/mol×K | 749.15 | Joback Calculated Property |
| Cp,gas | 346.91 | J/mol×K | 791.41 | Joback Calculated Property |
| Cp,gas | 352.83 | J/mol×K | 833.67 | Joback Calculated Property |
| Cp,gas | 358.13 | J/mol×K | 875.94 | Joback Calculated Property |
| Cp,gas | 362.90 | J/mol×K | 918.20 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Acetamide, N-(3-chlorophenyl)-2,2,2-trichloro-.
Sources
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