- InChI
- InChI=1S/C30H47F2NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-36-30(35)28-19-18-22-33(28)29(34)26-21-20-25(31)24-27(26)32/h20-21,24,28H,2-19,22-23H2,1H3
- InChI Key
- FLVUWQQERXOHPB-UHFFFAOYSA-N
- Formula
- C30H47F2NO3
- SMILES
-
CCCCCCCCCCCCCCCCCCOC(=O)C1CCCN
1C(=O)c1ccc(F)cc1F - Molecular Weight1
- 507.70
- 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 | 1.2608 | Relay (... Calculated Property | |
| ΔfG° | -297.59 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1162.17 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 143.32 | kJ/mol | Relay (... Calculated Property |
| IE | 9.13 | eV | Relay (... Calculated Property |
| log10WS | -8.26 | Relay (... Calculated Property | |
| logPoct/wat | 8.374 | Crippen Calculated Property | |
| McVol | 421.470 | ml/mol | McGowan Calculated Property |
| Pc | 363.69 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [3605.00; 3605.00] |
|
|
| Inp | 3605.00 | NIST | |
| Inp | 3605.00 | NIST | |
| Tboil | 724.81 | K | Relay (... Calculated Property |
| Tc | 942.95 | K | Relay (... Calculated Property |
| Tfus | 343.37 | K | Relay (... Calculated Property |
| Vc | 1.576 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to L-Proline, N-(2,4-difluorobenzoyl)-, octadecyl 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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