- InChI
- InChI=1S/C22H36F7NO3/c1-4-5-6-7-8-9-10-11-12-13-14-33-18(31)17(15-16(2)3)30-19(32)20(23,24)21(25,26)22(27,28)29/h16-17H,4-15H2,1-3H3,(H,30,32)
- InChI Key
- LQGCHSLGQVKGST-UHFFFAOYSA-N
- Formula
- C22H36F7NO3
- SMILES
-
CCCCCCCCCCCCOC(=O)C(CC(C)C)NC(
=O)C(F)(F)C(F)(F)C(F)(F)F - Molecular Weight1
- 495.51
- 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° | -1499.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2210.90 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 54.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.52 | kJ/mol | Joback Calculated Property |
| log10WS | -8.02 | Crippen Calculated Property | |
| logPoct/wat | 6.814 | Crippen Calculated Property | |
| McVol | 352.220 | ml/mol | McGowan Calculated Property |
| Pc | 840.16 | kPa | Joback Calculated Property |
| Inp | 2115.00 | NIST | |
| Tboil | 867.41 | K | Joback Calculated Property |
| Tc | 1063.99 | K | Joback Calculated Property |
| Tfus | 493.84 | K | Joback Calculated Property |
| Vc | 1.413 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1178.02; 1268.75] | J/mol×K | [867.41; 1063.99] | 
|
| Cp,gas | 1178.02 | J/mol×K | 867.41 | Joback Calculated Property |
| Cp,gas | 1195.60 | J/mol×K | 900.17 | Joback Calculated Property |
| Cp,gas | 1212.08 | J/mol×K | 932.94 | Joback Calculated Property |
| Cp,gas | 1227.53 | J/mol×K | 965.70 | Joback Calculated Property |
| Cp,gas | 1242.07 | J/mol×K | 998.46 | Joback Calculated Property |
| Cp,gas | 1255.78 | J/mol×K | 1031.22 | Joback Calculated Property |
| Cp,gas | 1268.75 | J/mol×K | 1063.99 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to l-Leucine, n-heptafluorobutyryl-, dodecyl ester.
Sources
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