- InChI
- InChI=1S/C12H5ClF10N2O2/c13-4-1-2-5(24-7(26)9(14,15)11(18,19)20)6(3-4)25-8(27)10(16,17)12(21,22)23/h1-3H,(H,24,26)(H,25,27)
- InChI Key
- XLFNBCHMPWQPGF-UHFFFAOYSA-N
- Formula
- C12H5ClF10N2O2
- SMILES
-
OC(=Nc1ccc(Cl)cc1N=C(O)C(F)(F)
C(F)(F)F)C(F)(F)C(F)(F)F - Molecular Weight1
- 434.62
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.8857 | Relay (1.0) Calculated Property | |
| ΔfG° | -1888.28 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -2345.82 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 107.97 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.03 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.43 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.911 | Crippen Calculated Property | |
| McVol | 209.220 | ml/mol | McGowan Calculated Property |
| Pc | 1605.13 | kPa | Joback Calculated Property |
| Inp | 1535.00 | NIST | |
| Tboil | 544.47 | K | Relay (1.0) Calculated Property |
| Tc | 748.69 | K | Relay (1.0) Calculated Property |
| Tfus | 386.12 | K | Relay (1.0) Calculated Property |
| Vc | 0.758 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to N,N'-(4-Chloro-1,2-phenylene)bis(2,2,3,3,3-pentafluoropropanamide).
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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