- InChI
- InChI=1S/C20H28F3NO3/c1-3-4-5-6-7-8-9-14-27-18(25)15-24(2)19(26)16-10-12-17(13-11-16)20(21,22)23/h10-13H,3-9,14-15H2,1-2H3
- InChI Key
- DQROQIASZXELOL-UHFFFAOYSA-N
- Formula
- C20H28F3NO3
- SMILES
-
CCCCCCCCCOC(=O)CN(C)C(=O)c1ccc
(C(F)(F)F)cc1 - Molecular Weight1
- 387.44
- 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° | -613.35 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1118.00 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 50.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.25 | kJ/mol | Joback Calculated Property |
| log10WS | -5.77 | Crippen Calculated Property | |
| logPoct/wat | 5.071 | Crippen Calculated Property | |
| McVol | 293.200 | ml/mol | McGowan Calculated Property |
| Pc | 1247.73 | kPa | Joback Calculated Property |
| Inp | 2394.00 | NIST | |
| Tboil | 825.84 | K | Joback Calculated Property |
| Tc | 1017.72 | K | Joback Calculated Property |
| Tfus | 512.85 | K | Joback Calculated Property |
| Vc | 1.139 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [913.80; 992.85] | J/mol×K | [825.84; 1017.72] | 
|
| Cp,gas | 913.80 | J/mol×K | 825.84 | Joback Calculated Property |
| Cp,gas | 929.30 | J/mol×K | 857.82 | Joback Calculated Property |
| Cp,gas | 943.80 | J/mol×K | 889.80 | Joback Calculated Property |
| Cp,gas | 957.35 | J/mol×K | 921.78 | Joback Calculated Property |
| Cp,gas | 970.00 | J/mol×K | 953.76 | Joback Calculated Property |
| Cp,gas | 981.82 | J/mol×K | 985.74 | Joback Calculated Property |
| Cp,gas | 992.85 | J/mol×K | 1017.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, N-(4-trifluoromethylbenzoyl)-, nonyl ester.
Sources
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