- InChI
- InChI=1S/C20H32F5NO3/c1-2-3-4-5-6-7-8-9-10-11-15-29-17(27)16-13-12-14-26(16)18(28)19(21,22)20(23,24)25/h16H,2-15H2,1H3
- InChI Key
- IWBPBGFESXPXFQ-UHFFFAOYSA-N
- Formula
- C20H32F5NO3
- SMILES
-
CCCCCCCCCCCCOC(=O)C1CCCN1C(=O)
C(F)(F)C(F)(F)F - Molecular Weight1
- 429.46
- 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 | 0.9338 | Relay (... Calculated Property | |
| ΔfG° | -1131.53 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1845.23 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 99.22 | kJ/mol | Relay (... Calculated Property |
| IE | 9.43 | eV | Relay (... Calculated Property |
| log10WS | -6.22 | Relay (... Calculated Property | |
| logPoct/wat | 5.639 | Crippen Calculated Property | |
| McVol | 309.640 | ml/mol | McGowan Calculated Property |
| Pc | 750.79 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | 2262.00 | NIST | |
| Tboil | 605.81 | K | Relay (... Calculated Property |
| Tc | 757.31 | K | Relay (... Calculated Property |
| Tfus | 301.74 | K | Relay (... Calculated Property |
| Vc | 1.158 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to l-Proline, n-pentafluoropropionyl-, dodecyl 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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