- InChI
- InChI=1S/C8H9F/c1-2-7-3-5-8(9)6-4-7/h3-6H,2H2,1H3
- InChI Key
- BLDNWXVISIXWKZ-UHFFFAOYSA-N
- Formula
- C8H9F
- SMILES
- CCc1ccc(F)cc1
- Molecular Weight1
- 124.16
- CAS
- 459-47-2
- Other Names
-
- p-Ethyl fluorobenzene
- 4-Ethylfluorobenzene
- 1-Ethyl-4-fluorobenzene
- Benzene, 1-ethyl-4-fluoro-
- 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 | 0.3225 | Relay (1.0) Calculated Property | |
| ΔfG° | -75.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -191.89 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.40 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.81 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.81 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.388 | Crippen Calculated Property | |
| McVol | 101.590 | ml/mol | McGowan Calculated Property |
| Pc | 3399.94 | kPa | Joback Calculated Property |
| Inp | [879.00; 879.00] |
|
|
| Inp | 879.00 | NIST | |
| Inp | 879.00 | NIST | |
| Tboil | 414.40 | K | Relay (1.0) Calculated Property |
| Tc | 610.95 | K | Relay (1.0) Calculated Property |
| Tfus | 204.20 | K | Relay (1.0) Calculated Property |
| Vc | 0.380 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [128.68; 317.56] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -1.78990e+01 | |||
| Coefficient B | 6.37220e-01 | |||
| Coefficient C | -3.91960e-04 | |||
| Coefficient D | 9.02000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 128.68 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 162.47 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 192.39 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 218.73 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 241.78 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 261.81 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 279.13 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 294.00 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 306.71 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 317.56 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to p-Fluoroethylbenzene.
Sources
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