- InChI
- InChI=1S/C13H5F6NO/c14-5-1-3-6(4-2-5)20-13(21)7-8(15)10(17)12(19)11(18)9(7)16/h1-4H,(H,20,21)
- InChI Key
- NXSQZVGPHXRXGT-UHFFFAOYSA-N
- Formula
- C13H5F6NO
- SMILES
-
O=C(Nc1ccc(F)cc1)c1c(F)c(F)c(F
)c(F)c1F - Molecular Weight1
- 305.18
- CAS
- 209109-65-9
- Other Names
-
- Benzamide, N-(4-fluorophenyl)-2,3,4,5,6-pentafluoro-
- 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° | -982.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1143.18 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.34 | kJ/mol | Joback Calculated Property |
| log10WS | -5.44 | Crippen Calculated Property | |
| logPoct/wat | 3.773 | Crippen Calculated Property | |
| McVol | 168.680 | ml/mol | McGowan Calculated Property |
| Pc | 2293.71 | kPa | Joback Calculated Property |
| Inp | 1716.00 | NIST | |
| Tboil | 679.74 | K | Joback Calculated Property |
| Tc | 875.59 | K | Joback Calculated Property |
| Tfus | 470.36 | K | Joback Calculated Property |
| Vc | 0.697 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [431.93; 481.93] | J/mol×K | [679.74; 875.59] | 
|
| Cp,gas | 431.93 | J/mol×K | 679.74 | Joback Calculated Property |
| Cp,gas | 441.80 | J/mol×K | 712.38 | Joback Calculated Property |
| Cp,gas | 451.04 | J/mol×K | 745.02 | Joback Calculated Property |
| Cp,gas | 459.66 | J/mol×K | 777.66 | Joback Calculated Property |
| Cp,gas | 467.66 | J/mol×K | 810.30 | Joback Calculated Property |
| Cp,gas | 475.08 | J/mol×K | 842.95 | Joback Calculated Property |
| Cp,gas | 481.93 | J/mol×K | 875.59 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,3,4,5,6-Pentafluoro-N-(4-fluorophenyl)benzamide.
Sources
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