- InChI
- InChI=1S/C18H24FNO3/c1-3-5-8-14(4-2)13-23-18(22)12-11-17(21)20-16-10-7-6-9-15(16)19/h6-7,9-12,14H,3-5,8,13H2,1-2H3,(H,20,21)/b12-11+
- InChI Key
- ZIEAWDRMBBMLPE-VAWYXSNFSA-N
- Formula
- C18H24FNO3
- SMILES
-
CCCCC(CC)COC(=O)C=CC(=O)Nc1ccc
cc1F - Molecular Weight1
- 321.39
- 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° | -187.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -577.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.69 | kJ/mol | Joback Calculated Property |
| log10WS | -4.67 | Crippen Calculated Property | |
| logPoct/wat | 4.080 | Crippen Calculated Property | |
| McVol | 257.180 | ml/mol | McGowan Calculated Property |
| Pc | 1609.00 | kPa | Joback Calculated Property |
| Inp | 2518.00 | NIST | |
| Tboil | 826.22 | K | Joback Calculated Property |
| Tc | 1030.55 | K | Joback Calculated Property |
| Tfus | 486.82 | K | Joback Calculated Property |
| Vc | 0.993 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [772.51; 845.86] | J/mol×K | [826.22; 1030.55] | 
|
| Cp,gas | 772.51 | J/mol×K | 826.22 | Joback Calculated Property |
| Cp,gas | 787.04 | J/mol×K | 860.28 | Joback Calculated Property |
| Cp,gas | 800.58 | J/mol×K | 894.33 | Joback Calculated Property |
| Cp,gas | 813.19 | J/mol×K | 928.39 | Joback Calculated Property |
| Cp,gas | 824.91 | J/mol×K | 962.44 | Joback Calculated Property |
| Cp,gas | 835.78 | J/mol×K | 996.50 | Joback Calculated Property |
| Cp,gas | 845.86 | J/mol×K | 1030.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, monoamide, N-(2-fluorophenyl)-, 2-ethylhexyl ester.
Sources
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