- InChI
- InChI=1S/C19H24F5NO3/c1-4-5-6-7-8-9-28-19(27)17(10(2)3)25-18(26)11-12(20)14(22)16(24)15(23)13(11)21/h10,17H,4-9H2,1-3H3,(H,25,26)
- InChI Key
- JDVCMUPEXLLOPF-UHFFFAOYSA-N
- Formula
- C19H24F5NO3
- SMILES
-
CCCCCCCOC(=O)C(NC(=O)c1c(F)c(F
)c(F)c(F)c1F)C(C)C - Molecular Weight1
- 409.39
- 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° | -1079.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1551.33 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 54.90 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.95 | kJ/mol | Joback Calculated Property |
| log10WS | -6.81 | Crippen Calculated Property | |
| logPoct/wat | 4.650 | Crippen Calculated Property | |
| McVol | 282.650 | ml/mol | McGowan Calculated Property |
| Pc | 1211.51 | kPa | Joback Calculated Property |
| Inp | [2190.00; 2190.00] |
|
|
| Inp | 2190.00 | NIST | |
| Inp | 2190.00 | NIST | |
| Tboil | 861.50 | K | Joback Calculated Property |
| Tc | 1055.91 | K | Joback Calculated Property |
| Tfus | 540.61 | K | Joback Calculated Property |
| Vc | 1.135 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [883.43; 951.79] | J/mol×K | [861.50; 1055.91] |
|
| Cp,gas | 883.43 | J/mol×K | 861.50 | Joback Calculated Property |
| Cp,gas | 897.28 | J/mol×K | 893.90 | Joback Calculated Property |
| Cp,gas | 910.13 | J/mol×K | 926.30 | Joback Calculated Property |
| Cp,gas | 921.98 | J/mol×K | 958.71 | Joback Calculated Property |
| Cp,gas | 932.87 | J/mol×K | 991.11 | Joback Calculated Property |
| Cp,gas | 942.80 | J/mol×K | 1023.51 | Joback Calculated Property |
| Cp,gas | 951.79 | J/mol×K | 1055.91 | Joback Calculated Property |
Similar Compounds
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Sources
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