- InChI
- InChI=1S/C24H42F5NO3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-33-21(31)20(19(3)5-2)30-22(32)23(25,26)24(27,28)29/h19-20H,4-18H2,1-3H3,(H,30,32)
- InChI Key
- KHOLERYBJWHMLD-UHFFFAOYSA-N
- Formula
- C24H42F5NO3
- SMILES
-
CCCCCCCCCCCCCCCOC(=O)C(NC(=O)C
(F)(F)C(F)(F)F)C(C)CC - Molecular Weight1
- 487.59
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion 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 | 1.0777 | Relay (... Calculated Property | |
| ΔfG° | -1095.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2013.20 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 60.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 112.42 | kJ/mol | Relay (... Calculated Property |
| IE | 9.58 | eV | Relay (... Calculated Property |
| log10WS | -7.62 | Relay (... Calculated Property | |
| logPoct/wat | 7.349 | Crippen Calculated Property | |
| McVol | 376.860 | ml/mol | McGowan Calculated Property |
| Pc | 784.19 | kPa | Joback Calculated Property |
| Inp | 2409.00 | NIST | |
| Tboil | 608.03 | K | Relay (... Calculated Property |
| Tc | 759.61 | K | Relay (... Calculated Property |
| Tfus | 339.41 | K | Relay (... Calculated Property |
| Vc | 1.382 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1287.22; 1386.16] | J/mol×K | [917.86; 1129.98] | 
|
| Cp,gas | 1287.22 | J/mol×K | 917.86 | Joback Calculated Property |
| Cp,gas | 1306.62 | J/mol×K | 953.21 | Joback Calculated Property |
| Cp,gas | 1324.71 | J/mol×K | 988.57 | Joback Calculated Property |
| Cp,gas | 1341.62 | J/mol×K | 1023.92 | Joback Calculated Property |
| Cp,gas | 1357.42 | J/mol×K | 1059.28 | Joback Calculated Property |
| Cp,gas | 1372.24 | J/mol×K | 1094.63 | Joback Calculated Property |
| Cp,gas | 1386.16 | J/mol×K | 1129.98 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to l-Isoleucine, n-pentafluoropropionyl-, pentadecyl ester.
Sources
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