- InChI
- InChI=1S/C21H31F2NO3/c1-3-4-5-6-7-8-9-10-11-15-27-19(25)16-24(2)21(26)20-17(22)13-12-14-18(20)23/h12-14H,3-11,15-16H2,1-2H3
- InChI Key
- ZHIGEAAJDWTZNF-UHFFFAOYSA-N
- Formula
- C21H31F2NO3
- SMILES
-
CCCCCCCCCCCOC(=O)CN(C)C(=O)c1c
(F)cccc1F - Molecular Weight1
- 383.47
- 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° | -422.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -945.25 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 56.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.25 | kJ/mol | Joback Calculated Property |
| log10WS | -6.16 | Crippen Calculated Property | |
| logPoct/wat | 5.111 | Crippen Calculated Property | |
| McVol | 305.520 | ml/mol | McGowan Calculated Property |
| Pc | 1176.05 | kPa | Joback Calculated Property |
| Inp | 2730.00 | NIST | |
| Tboil | 857.66 | K | Joback Calculated Property |
| Tc | 1052.86 | K | Joback Calculated Property |
| Tfus | 533.63 | K | Joback Calculated Property |
| Vc | 1.188 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [964.07; 1045.41] | J/mol×K | [857.66; 1052.86] | 
|
| Cp,gas | 964.07 | J/mol×K | 857.66 | Joback Calculated Property |
| Cp,gas | 980.17 | J/mol×K | 890.19 | Joback Calculated Property |
| Cp,gas | 995.20 | J/mol×K | 922.73 | Joback Calculated Property |
| Cp,gas | 1009.20 | J/mol×K | 955.26 | Joback Calculated Property |
| Cp,gas | 1022.21 | J/mol×K | 987.80 | Joback Calculated Property |
| Cp,gas | 1034.27 | J/mol×K | 1020.33 | Joback Calculated Property |
| Cp,gas | 1045.41 | J/mol×K | 1052.86 | Joback Calculated Property |
Similar Compounds
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Sources
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