- InChI
- InChI=1S/C8H7FO2/c1-5(10)7-4-6(9)2-3-8(7)11/h2-4,11H,1H3
- InChI Key
- KOFFXZYMDLWRHX-UHFFFAOYSA-N
- Formula
- C8H7FO2
- SMILES
- CC(=O)c1cc(F)ccc1O
- Molecular Weight1
- 154.14
- CAS
- 394-32-1
- Other Names
-
- 2-Hydroxy-5-fluoroacetophenone
- 5'-Fluoro-2'-hydroxyacetophenone
- Ethanone, 1-(5-fluoro-2-hydroxyphenyl)-
- 1-(5-fluoro-2-hydroxyphenyl)ethan-1-one
- 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).
- 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 | 0.5652 | Relay (... Calculated Property | |
| ΔfG° | -359.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -503.98 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 20.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.09 | kJ/mol | Relay (... Calculated Property |
| IE | 8.66 | eV | Relay (... Calculated Property |
| log10WS | -1.80 | Relay (... Calculated Property | |
| logPoct/wat | 1.734 | Crippen Calculated Property | |
| McVol | 109.030 | ml/mol | McGowan Calculated Property |
| Pc | 4426.72 | kPa | Joback Calculated Property |
| Tboil | 491.69 | K | Relay (... Calculated Property |
| Tc | 742.63 | K | Relay (... Calculated Property |
| Tfus | 298.27 | K | Relay (... Calculated Property |
| Vc | 0.388 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [245.26; 293.61] | J/mol×K | [547.86; 772.34] | 
|
| Cp,gas | 245.26 | J/mol×K | 547.86 | Joback Calculated Property |
| Cp,gas | 254.87 | J/mol×K | 585.27 | Joback Calculated Property |
| Cp,gas | 263.76 | J/mol×K | 622.69 | Joback Calculated Property |
| Cp,gas | 272.02 | J/mol×K | 660.10 | Joback Calculated Property |
| Cp,gas | 279.70 | J/mol×K | 697.51 | Joback Calculated Property |
| Cp,gas | 286.87 | J/mol×K | 734.92 | Joback Calculated Property |
| Cp,gas | 293.61 | J/mol×K | 772.34 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 5-Fluoro-2-hydroxyacetophenone.
Sources
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