- InChI
- InChI=1S/C10H9F8NO3/c11-8(12,10(16,17)18)4-22-6(20)5-2-1-3-19(5)7(21)9(13,14)15/h5H,1-4H2
- InChI Key
- WUMSDKKXNIAXOC-UHFFFAOYSA-N
- Formula
- C10H9F8NO3
- SMILES
-
O=C(OCC(F)(F)C(F)(F)F)C1CCCN1C
(=O)C(F)(F)F - Molecular Weight1
- 343.17
- 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 | 0.5729 | Relay (1.0) Calculated Property | |
| ΔfG° | -1675.97 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -2201.06 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 67.58 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.07 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.35 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.280 | Crippen Calculated Property | |
| McVol | 174.050 | ml/mol | McGowan Calculated Property |
| Pc | 1693.70 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 1187.60 | NIST | |
| Tboil | 484.47 | K | Relay (1.0) Calculated Property |
| Tc | 643.71 | K | Relay (1.0) Calculated Property |
| Tfus | 303.20 | K | Relay (1.0) Calculated Property |
| Vc | 0.661 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to L-Proline, N-trifluoroacetyl-, 2,2,3,3,3-pentafluoropropyl ester.
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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