![Phosphine, tris[4-(trifluoromethyl)phenyl]-](/cid/94-640-7/Phosphine-tris-4-trifluoromethyl-phenyl.png "Phosphine, tris[4-(trifluoromethyl)phenyl]-")
- InChI
- InChI=1S/C21H12F9P/c22-19(23,24)13-1-7-16(8-2-13)31(17-9-3-14(4-10-17)20(25,26)27)18-11-5-15(6-12-18)21(28,29)30/h1-12H
- InChI Key
- PXYCJKZSCDFXLR-UHFFFAOYSA-N
- Formula
- C21H12F9P
- SMILES
-
FC(F)(F)c1ccc(P(c2ccc(C(F)(F)F
)cc2)c2ccc(C(F)(F)F)cc2)cc1 - Molecular Weight1
- 466.28
- CAS
- 13406-29-6
- Other Names
-
- Phosphine, tris(«alpha»,«alpha»,«alpha»-trifluoro-p-tolyl)-
- Tris[(p-trifluoromethyl)phenyl]phosphine
- 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).
- 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 | 0.6778 | Relay (1.0) Calculated Property | |
| ΔfG° | -1192.75 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1740.99 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 92.97 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.42 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.94 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.501 | Crippen Calculated Property | |
| McVol | 271.860 | ml/mol | McGowan Calculated Property |
| Pc | 1377.32 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 663.98 | K | Relay (1.0) Calculated Property |
| Tc | 912.41 | K | Relay (1.0) Calculated Property |
| Tfus | 454.15 | K | Relay (1.0) Calculated Property |
| Vc | 1.004 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Phosphine, tris[4-(trifluoromethyl)phenyl]-.
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
- McGowan Method
- NIST Webbook
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