- InChI
- InChI=1S/C8H5BrCl3NO/c9-5-1-3-6(4-2-5)13-7(14)8(10,11)12/h1-4H,(H,13,14)
- InChI Key
- UGJPWLNLVKYGLV-UHFFFAOYSA-N
- Formula
- C8H5BrCl3NO
- SMILES
- O=C(Nc1ccc(Br)cc1)C(Cl)(Cl)Cl
- Molecular Weight1
- 317.39
- 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° | 61.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -72.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.82 | kJ/mol | Joback Calculated Property |
| log10WS | -4.40 | Crippen Calculated Property | |
| logPoct/wat | 3.758 | Crippen Calculated Property | |
| McVol | 165.590 | ml/mol | McGowan Calculated Property |
| Pc | 3824.55 | kPa | Joback Calculated Property |
| Inp | 1892.00 | NIST | |
| Tboil | 693.36 | K | Joback Calculated Property |
| Tc | 955.64 | K | Joback Calculated Property |
| Tfus | 473.43 | K | Joback Calculated Property |
| Vc | 0.615 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [331.21; 367.39] | J/mol×K | [693.36; 955.64] | 
|
| Cp,gas | 331.21 | J/mol×K | 693.36 | Joback Calculated Property |
| Cp,gas | 339.03 | J/mol×K | 737.07 | Joback Calculated Property |
| Cp,gas | 345.98 | J/mol×K | 780.79 | Joback Calculated Property |
| Cp,gas | 352.19 | J/mol×K | 824.50 | Joback Calculated Property |
| Cp,gas | 357.75 | J/mol×K | 868.22 | Joback Calculated Property |
| Cp,gas | 362.78 | J/mol×K | 911.93 | Joback Calculated Property |
| Cp,gas | 367.39 | J/mol×K | 955.64 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Acetamide, N-(4-bromophenyl)-2,2,2-trichloro-.
Sources
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