- InChI
- InChI=1S/C18H30F5NO3S/c1-3-4-5-6-7-8-9-10-12-27-15(25)14(11-13-28-2)24-16(26)17(19,20)18(21,22)23/h14H,3-13H2,1-2H3,(H,24,26)
- InChI Key
- IARFMHZEUTYHEI-UHFFFAOYSA-N
- Formula
- C18H30F5NO3S
- SMILES
-
CCCCCCCCCCOC(=O)C(CCSC)NC(=O)C
(F)(F)C(F)(F)F - Molecular Weight1
- 435.49
- 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° | -1110.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1680.22 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 53.04 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.75 | kJ/mol | Joback Calculated Property |
| log10WS | -6.16 | Crippen Calculated Property | |
| logPoct/wat | 5.106 | Crippen Calculated Property | |
| McVol | 308.670 | ml/mol | McGowan Calculated Property |
| Pc | 1121.55 | kPa | Joback Calculated Property |
| Inp | 2180.00 | NIST | |
| Tboil | 849.80 | K | Joback Calculated Property |
| Tc | 1041.32 | K | Joback Calculated Property |
| Tfus | 494.56 | K | Joback Calculated Property |
| Vc | 1.224 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [985.01; 1060.47] | J/mol×K | [849.80; 1041.32] | 
|
| Cp,gas | 985.01 | J/mol×K | 849.80 | Joback Calculated Property |
| Cp,gas | 999.91 | J/mol×K | 881.72 | Joback Calculated Property |
| Cp,gas | 1013.80 | J/mol×K | 913.64 | Joback Calculated Property |
| Cp,gas | 1026.75 | J/mol×K | 945.56 | Joback Calculated Property |
| Cp,gas | 1038.81 | J/mol×K | 977.48 | Joback Calculated Property |
| Cp,gas | 1050.03 | J/mol×K | 1009.40 | Joback Calculated Property |
| Cp,gas | 1060.47 | J/mol×K | 1041.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to l-Methionine, n-pentafluoropropionyl-, decyl ester.
Sources
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