- InChI
- InChI=1S/C7H5ClFNO/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,(H2,10,11)
- InChI Key
- KGTCFPJGIYHDRZ-UHFFFAOYSA-N
- Formula
- C7H5ClFNO
- SMILES
- NC(=O)c1cccc(Cl)c1F
- Molecular Weight1
- 173.57
- CAS
- 104326-94-5
- 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° | -168.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -264.86 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.73 | kJ/mol | Joback Calculated Property |
| log10WS | -2.66 | Crippen Calculated Property | |
| logPoct/wat | 1.578 | Crippen Calculated Property | |
| McVol | 111.290 | ml/mol | McGowan Calculated Property |
| Pc | 4156.97 | kPa | Joback Calculated Property |
| Tboil | 559.30 | K | Joback Calculated Property |
| Tc | 790.89 | K | Joback Calculated Property |
| Tfus | 383.81 | K | Joback Calculated Property |
| Vc | 0.421 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [229.32; 272.42] | J/mol×K | [559.30; 790.89] | 
|
| Cp,gas | 229.32 | J/mol×K | 559.30 | Joback Calculated Property |
| Cp,gas | 237.92 | J/mol×K | 597.90 | Joback Calculated Property |
| Cp,gas | 245.92 | J/mol×K | 636.50 | Joback Calculated Property |
| Cp,gas | 253.35 | J/mol×K | 675.09 | Joback Calculated Property |
| Cp,gas | 260.23 | J/mol×K | 713.69 | Joback Calculated Property |
| Cp,gas | 266.58 | J/mol×K | 752.29 | Joback Calculated Property |
| Cp,gas | 272.42 | J/mol×K | 790.89 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Chloro-2-fluorobenzamide.
Sources
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