- InChI
- InChI=1S/C23H40F5NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-32-20(30)17-18-29-21(31)22(24,25)23(26,27)28/h2-19H2,1H3,(H,29,31)
- InChI Key
- SVPAUDRNJZGLSS-UHFFFAOYSA-N
- Formula
- C23H40F5NO3
- SMILES
-
CCCCCCCCCCCCCCCCCOC(=O)CCNC(=O
)C(F)(F)C(F)(F)F - Molecular Weight1
- 473.56
- 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° | -1099.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1820.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 65.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.45 | kJ/mol | Joback Calculated Property |
| log10WS | -8.25 | Crippen Calculated Property | |
| logPoct/wat | 7.105 | Crippen Calculated Property | |
| McVol | 362.770 | ml/mol | McGowan Calculated Property |
| Pc | 820.54 | kPa | Joback Calculated Property |
| Inp | 2536.00 | NIST | |
| Tboil | 895.86 | K | Joback Calculated Property |
| Tc | 1102.14 | K | Joback Calculated Property |
| Tfus | 531.51 | K | Joback Calculated Property |
| Vc | 1.456 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1223.97; 1321.05] | J/mol×K | [895.86; 1102.14] | 
|
| Cp,gas | 1223.97 | J/mol×K | 895.86 | Joback Calculated Property |
| Cp,gas | 1242.89 | J/mol×K | 930.24 | Joback Calculated Property |
| Cp,gas | 1260.59 | J/mol×K | 964.62 | Joback Calculated Property |
| Cp,gas | 1277.17 | J/mol×K | 999.00 | Joback Calculated Property |
| Cp,gas | 1292.71 | J/mol×K | 1033.38 | Joback Calculated Property |
| Cp,gas | 1307.31 | J/mol×K | 1067.76 | Joback Calculated Property |
| Cp,gas | 1321.05 | J/mol×K | 1102.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to «beta»-Alanine, n-pentafluoropropionyl-, heptadecyl ester.
Sources
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