- InChI
- InChI=1S/C14H11FO3/c1-18-9-6-7-11(13(16)8-9)14(17)10-4-2-3-5-12(10)15/h2-8,16H,1H3
- InChI Key
- VVOYPINUWBAVQM-UHFFFAOYSA-N
- Formula
- C14H11FO3
- SMILES
- COc1ccc(C(=O)c2ccccc2F)c(O)c1
- Molecular Weight1
- 246.23
- CAS
- 3119-88-8
- 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).
- ΔsubH : Enthalpy of sublimation at a given temperature (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).
- 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° | -310.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -500.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.99 | kJ/mol | Joback Calculated Property |
| log10WS | -3.43 | Crippen Calculated Property | |
| logPoct/wat | 2.771 | Crippen Calculated Property | |
| McVol | 175.680 | ml/mol | McGowan Calculated Property |
| Pc | 3156.17 | kPa | Joback Calculated Property |
| Tboil | 739.22 | K | Joback Calculated Property |
| Tc | 979.74 | K | Joback Calculated Property |
| Tfus | 509.89 | K | Joback Calculated Property |
| Vc | 0.612 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [469.26; 531.21] | J/mol×K | [739.22; 979.74] | 
|
| Cp,gas | 469.26 | J/mol×K | 739.22 | Joback Calculated Property |
| Cp,gas | 481.44 | J/mol×K | 779.31 | Joback Calculated Property |
| Cp,gas | 492.76 | J/mol×K | 819.39 | Joback Calculated Property |
| Cp,gas | 503.31 | J/mol×K | 859.48 | Joback Calculated Property |
| Cp,gas | 513.17 | J/mol×K | 899.57 | Joback Calculated Property |
| Cp,gas | 522.44 | J/mol×K | 939.65 | Joback Calculated Property |
| Cp,gas | 531.21 | J/mol×K | 979.74 | Joback Calculated Property |
| ΔsubH | 109.30 | kJ/mol | 312.50 | NIST |
Similar Compounds
Find more compounds similar to 2'-Fluoro-2-hydroxy-4-methoxybenzophenone.
Sources
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