- InChI
- InChI=1S/C32H39F8NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-41(29(42)23-18-16-20-25(27(23)33)31(35,36)37)30(43)24-19-17-21-26(28(24)34)32(38,39)40/h16-21H,2-15,22H2,1H3
- InChI Key
- QONXEFXLVRUPHE-UHFFFAOYSA-N
- Formula
- C32H39F8NO2
- SMILES
-
CCCCCCCCCCCCCCCCN(C(=O)c1cccc(
C(F)(F)F)c1F)C(=O)c1cccc(C(F)( F)F)c1F - Molecular Weight1
- 621.64
- 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° | -1295.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2020.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 81.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.43 | kJ/mol | Joback Calculated Property |
| log10WS | -12.73 | Crippen Calculated Property | |
| logPoct/wat | 10.766 | Crippen Calculated Property | |
| McVol | 441.500 | ml/mol | McGowan Calculated Property |
| Pc | 662.21 | kPa | Joback Calculated Property |
| Inp | 3128.00 | NIST | |
| Tboil | 1112.72 | K | Joback Calculated Property |
| Tc | 1398.38 | K | Joback Calculated Property |
| Tfus | 695.21 | K | Joback Calculated Property |
| Vc | 1.764 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1550.64; 1664.36] | J/mol×K | [1112.72; 1398.38] | 
|
| Cp,gas | 1550.64 | J/mol×K | 1112.72 | Joback Calculated Property |
| Cp,gas | 1570.94 | J/mol×K | 1160.33 | Joback Calculated Property |
| Cp,gas | 1590.25 | J/mol×K | 1207.94 | Joback Calculated Property |
| Cp,gas | 1608.91 | J/mol×K | 1255.55 | Joback Calculated Property |
| Cp,gas | 1627.25 | J/mol×K | 1303.16 | Joback Calculated Property |
| Cp,gas | 1645.62 | J/mol×K | 1350.77 | Joback Calculated Property |
| Cp,gas | 1664.36 | J/mol×K | 1398.38 | Joback Calculated Property |
Similar Compounds
Sources
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