- InChI
- InChI=1S/C14H20F7NO3/c1-7(2)5-9(10(23)25-6-8(3)4)22-11(24)12(15,16)13(17,18)14(19,20)21/h7-9H,5-6H2,1-4H3,(H,22,24)
- InChI Key
- IXCYRBAXLXHEPV-UHFFFAOYSA-N
- Formula
- C14H20F7NO3
- SMILES
-
CC(C)COC(=O)C(CC(C)C)NC(=O)C(F
)(F)C(F)(F)C(F)(F)F - Molecular Weight1
- 383.30
- 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° | -1568.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2051.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.25 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.33 | kJ/mol | Joback Calculated Property |
| log10WS | -4.43 | Crippen Calculated Property | |
| logPoct/wat | 3.549 | Crippen Calculated Property | |
| McVol | 239.500 | ml/mol | McGowan Calculated Property |
| Pc | 1398.55 | kPa | Joback Calculated Property |
| Inp | 1365.00 | NIST | |
| Tboil | 683.93 | K | Joback Calculated Property |
| Tc | 852.09 | K | Joback Calculated Property |
| Tfus | 388.68 | K | Joback Calculated Property |
| Vc | 0.960 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [716.05; 786.90] | J/mol×K | [683.93; 852.09] | 
|
| Cp,gas | 716.05 | J/mol×K | 683.93 | Joback Calculated Property |
| Cp,gas | 729.82 | J/mol×K | 711.96 | Joback Calculated Property |
| Cp,gas | 742.74 | J/mol×K | 739.98 | Joback Calculated Property |
| Cp,gas | 754.86 | J/mol×K | 768.01 | Joback Calculated Property |
| Cp,gas | 766.23 | J/mol×K | 796.04 | Joback Calculated Property |
| Cp,gas | 776.90 | J/mol×K | 824.07 | Joback Calculated Property |
| Cp,gas | 786.90 | J/mol×K | 852.09 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to l-Leucine, n-heptafluorobutyryl-, isobutyl ester.
Sources
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