- InChI
- InChI=1S/C19H32F5NO3/c1-4-6-7-8-9-10-11-12-13-28-16(26)15(14(3)5-2)25-17(27)18(20,21)19(22,23)24/h14-15H,4-13H2,1-3H3,(H,25,27)
- InChI Key
- VOGQDFGPQBLICO-UHFFFAOYSA-N
- Formula
- C19H32F5NO3
- SMILES
-
CCCCCCCCCCOC(=O)C(NC(=O)C(F)(F
)C(F)(F)F)C(C)CC - Molecular Weight1
- 417.45
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -1137.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1748.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.77 | kJ/mol | Joback Calculated Property |
| log10WS | -6.45 | Crippen Calculated Property | |
| logPoct/wat | 5.399 | Crippen Calculated Property | |
| McVol | 306.410 | ml/mol | McGowan Calculated Property |
| Pc | 1046.65 | kPa | Joback Calculated Property |
| Inp | 1929.00 | NIST | |
| Tboil | 803.46 | K | Joback Calculated Property |
| Tc | 984.55 | K | Joback Calculated Property |
| Tfus | 456.43 | K | Joback Calculated Property |
| Vc | 1.220 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [981.98; 1066.48] | J/mol×K | [803.46; 984.55] | 
|
| Cp,gas | 981.98 | J/mol×K | 803.46 | Joback Calculated Property |
| Cp,gas | 998.31 | J/mol×K | 833.64 | Joback Calculated Property |
| Cp,gas | 1013.67 | J/mol×K | 863.82 | Joback Calculated Property |
| Cp,gas | 1028.12 | J/mol×K | 894.01 | Joback Calculated Property |
| Cp,gas | 1041.70 | J/mol×K | 924.19 | Joback Calculated Property |
| Cp,gas | 1054.47 | J/mol×K | 954.37 | Joback Calculated Property |
| Cp,gas | 1066.48 | J/mol×K | 984.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to l-Isoleucine, n-pentafluoropropionyl-, decyl ester.
Sources
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