- InChI
- InChI=1S/C16H24F5NO3/c1-2-3-4-5-6-7-11-25-13(23)12-9-8-10-22(12)14(24)15(17,18)16(19,20)21/h12H,2-11H2,1H3
- InChI Key
- IQETVZHKHOYRJR-UHFFFAOYSA-N
- Formula
- C16H24F5NO3
- SMILES
-
CCCCCCCCOC(=O)C1CCCN1C(=O)C(F)
(F)C(F)(F)F - Molecular Weight1
- 373.36
- 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 | 0.7834 | Relay (... Calculated Property | |
| ΔfG° | -1170.75 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1765.54 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 82.62 | kJ/mol | Relay (... Calculated Property |
| IE | 9.39 | eV | Relay (... Calculated Property |
| log10WS | -4.92 | Relay (... Calculated Property | |
| logPoct/wat | 4.079 | Crippen Calculated Property | |
| McVol | 253.280 | ml/mol | McGowan Calculated Property |
| Pc | 1111.72 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1865.00; 1865.00] |
|
|
| Inp | 1865.00 | NIST | |
| Inp | 1865.00 | NIST | |
| Tboil | 564.54 | K | Relay (... Calculated Property |
| Tc | 714.96 | K | Relay (... Calculated Property |
| Tfus | 284.85 | K | Relay (... Calculated Property |
| Vc | 0.941 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to l-Proline, n-pentafluoropropionyl-, octyl 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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