- InChI
- InChI=1S/C15H19F2NO3/c1-2-3-4-10-21-13(19)8-9-18-15(20)14-11(16)6-5-7-12(14)17/h5-7H,2-4,8-10H2,1H3,(H,18,20)
- InChI Key
- IEBGJBALOIZJOI-UHFFFAOYSA-N
- Formula
- C15H19F2NO3
- SMILES
-
CCCCCOC(=O)CCNC(=O)c1c(F)cccc1
F - Molecular Weight1
- 299.31
- 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).
- 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 |
|---|---|---|---|
| ω | 0.8281 | Relay (1.0) Calculated Property | |
| ΔfG° | -494.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -914.59 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 43.51 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.22 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.19 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.30 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.818 | Crippen Calculated Property | |
| McVol | 220.980 | ml/mol | McGowan Calculated Property |
| Pc | 1849.92 | kPa | Joback Calculated Property |
| Inp | 2166.00 | NIST | |
| Tboil | 604.80 | K | Relay (1.0) Calculated Property |
| Tc | 823.27 | K | Relay (1.0) Calculated Property |
| Tfus | 332.16 | K | Relay (1.0) Calculated Property |
| Vc | 0.809 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [635.94; 703.71] | J/mol×K | [758.11; 951.97] | 
|
| Cp,gas | 635.94 | J/mol×K | 758.11 | Joback Calculated Property |
| Cp,gas | 649.29 | J/mol×K | 790.42 | Joback Calculated Property |
| Cp,gas | 661.79 | J/mol×K | 822.73 | Joback Calculated Property |
| Cp,gas | 673.46 | J/mol×K | 855.04 | Joback Calculated Property |
| Cp,gas | 684.32 | J/mol×K | 887.35 | Joback Calculated Property |
| Cp,gas | 694.40 | J/mol×K | 919.66 | Joback Calculated Property |
| Cp,gas | 703.71 | J/mol×K | 951.97 | Joback Calculated Property |
Similar Compounds
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Sources
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