- InChI
- InChI=1S/C9H9ClFNO/c1-6(10)9(13)12-8-4-2-7(11)3-5-8/h2-6H,1H3,(H,12,13)
- InChI Key
- WIDIGWZTSCBRNS-UHFFFAOYSA-N
- Formula
- C9H9ClFNO
- SMILES
- CC(Cl)C(=O)Nc1ccc(F)cc1
- Molecular Weight1
- 201.62
- 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° | -121.03 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -280.27 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.93 | kJ/mol | Joback Calculated Property |
| log10WS | -2.69 | Crippen Calculated Property | |
| logPoct/wat | 2.391 | Crippen Calculated Property | |
| McVol | 139.470 | ml/mol | McGowan Calculated Property |
| Pc | 3213.68 | kPa | Joback Calculated Property |
| Inp | 1439.00 | NIST | |
| Tboil | 577.28 | K | Joback Calculated Property |
| Tc | 795.26 | K | Joback Calculated Property |
| Tfus | 348.23 | K | Joback Calculated Property |
| Vc | 0.533 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [311.38; 369.52] | J/mol×K | [577.28; 795.26] | 
|
| Cp,gas | 311.38 | J/mol×K | 577.28 | Joback Calculated Property |
| Cp,gas | 322.90 | J/mol×K | 613.61 | Joback Calculated Property |
| Cp,gas | 333.64 | J/mol×K | 649.94 | Joback Calculated Property |
| Cp,gas | 343.65 | J/mol×K | 686.27 | Joback Calculated Property |
| Cp,gas | 352.94 | J/mol×K | 722.60 | Joback Calculated Property |
| Cp,gas | 361.55 | J/mol×K | 758.93 | Joback Calculated Property |
| Cp,gas | 369.52 | J/mol×K | 795.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, N-(4-fluorophenyl)-2-chloro-.
Sources
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