- InChI
- InChI=1S/C4F9/c5-1(3(8,9)10)2(6,7)4(11,12)13
- InChI Key
- VWIYRCOUQNNNFI-UHFFFAOYSA-N
- Formula
- C4F9
- SMILES
- F[C](C(F)(F)F)C(F)(F)C(F)(F)F
- Molecular Weight1
- 219.03
- CAS
- 4556-27-8
- ω : Acentric Factor.
- EA : Electron affinity (eV).
- 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 | 0.3497 | Relay (... Calculated Property | |
| EA | [3.55; 3.55] | eV |
|
| EA | 3.55 ± 0.50 | eV | NIST |
| EA | 3.55 ± 0.50 | eV | NIST |
| ΔfG° | -1736.99 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1916.86 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 23.24 | kJ/mol | Relay (... Calculated Property |
| IE | 10.85 | eV | Relay (... Calculated Property |
| log10WS | -3.69 | Relay (... Calculated Property | |
| logPoct/wat | 3.248 | Crippen Calculated Property | |
| McVol | 81.000 | ml/mol | McGowan Calculated Property |
| Pc | 2399.91 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 280.61 | K | Relay (... Calculated Property |
| Tc | 394.67 | K | Relay (... Calculated Property |
| Tfus | 130.40 | K | Relay (... Calculated Property |
| Vc | 0.348 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Propyl,hexaflouro-2-triflouromethyl.
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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