- InChI
- InChI=1S/C25H39F2NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-31-23(29)20-28(2)25(30)24-21(26)17-16-18-22(24)27/h16-18H,3-15,19-20H2,1-2H3
- InChI Key
- SDTQVJRLDZFWHF-UHFFFAOYSA-N
- Formula
- C25H39F2NO3
- SMILES
-
CCCCCCCCCCCCCCCOC(=O)CN(C)C(=O
)c1c(F)cccc1F - Molecular Weight1
- 439.58
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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).
- 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 |
|---|---|---|---|
| ω | 1.1589 | Relay (1.0) Calculated Property | |
| ΔfG° | -388.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1068.36 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 67.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 123.41 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.02 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.17 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.671 | Crippen Calculated Property | |
| McVol | 361.880 | ml/mol | McGowan Calculated Property |
| Pc | 918.27 | kPa | Joback Calculated Property |
| Tboil | 665.65 | K | Relay (1.0) Calculated Property |
| Tc | 881.19 | K | Relay (1.0) Calculated Property |
| Tfus | 335.47 | K | Relay (1.0) Calculated Property |
| Vc | 1.366 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1208.37; 1295.83] | J/mol×K | [949.18; 1163.23] | 
|
| Cp,gas | 1208.37 | J/mol×K | 949.18 | Joback Calculated Property |
| Cp,gas | 1226.09 | J/mol×K | 984.85 | Joback Calculated Property |
| Cp,gas | 1242.47 | J/mol×K | 1020.53 | Joback Calculated Property |
| Cp,gas | 1257.57 | J/mol×K | 1056.20 | Joback Calculated Property |
| Cp,gas | 1271.45 | J/mol×K | 1091.88 | Joback Calculated Property |
| Cp,gas | 1284.18 | J/mol×K | 1127.55 | Joback Calculated Property |
| Cp,gas | 1295.83 | J/mol×K | 1163.23 | Joback Calculated Property |
Similar Compounds
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Sources
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