- InChI
- InChI=1S/C13H15F2NO3/c1-3-7-19-11(17)8-16(2)13(18)12-9(14)5-4-6-10(12)15/h4-6H,3,7-8H2,1-2H3
- InChI Key
- KWPIFXGJDORBCR-UHFFFAOYSA-N
- Formula
- C13H15F2NO3
- SMILES
-
CCCOC(=O)CN(C)C(=O)c1c(F)cccc1
F - Molecular Weight1
- 271.26
- 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° | -489.95 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -780.13 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 36.26 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.44 | kJ/mol | Joback Calculated Property |
| log10WS | -2.82 | Crippen Calculated Property | |
| logPoct/wat | 1.990 | Crippen Calculated Property | |
| McVol | 192.800 | ml/mol | McGowan Calculated Property |
| Pc | 2167.36 | kPa | Joback Calculated Property |
| Inp | 1902.00 | NIST | |
| Tboil | 674.62 | K | Joback Calculated Property |
| Tc | 867.65 | K | Joback Calculated Property |
| Tfus | 443.47 | K | Joback Calculated Property |
| Vc | 0.740 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [515.11; 582.43] | J/mol×K | [674.62; 867.65] | 
|
| Cp,gas | 515.11 | J/mol×K | 674.62 | Joback Calculated Property |
| Cp,gas | 528.21 | J/mol×K | 706.79 | Joback Calculated Property |
| Cp,gas | 540.54 | J/mol×K | 738.96 | Joback Calculated Property |
| Cp,gas | 552.11 | J/mol×K | 771.14 | Joback Calculated Property |
| Cp,gas | 562.93 | J/mol×K | 803.31 | Joback Calculated Property |
| Cp,gas | 573.03 | J/mol×K | 835.48 | Joback Calculated Property |
| Cp,gas | 582.43 | J/mol×K | 867.65 | Joback Calculated Property |
Similar Compounds
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Sources
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