- InChI
- InChI=1S/C15H12F2O2/c1-10(14-12(16)8-5-9-13(14)17)19-15(18)11-6-3-2-4-7-11/h2-10H,1H3
- InChI Key
- JFYUZPRGWAUQJN-UHFFFAOYSA-N
- Formula
- C15H12F2O2
- SMILES
- CC(OC(=O)c1ccccc1)c1c(F)cccc1F
- Molecular Weight1
- 262.25
- 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° | -345.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -545.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.99 | kJ/mol | Joback Calculated Property |
| log10WS | -4.87 | Crippen Calculated Property | |
| logPoct/wat | 3.883 | Crippen Calculated Property | |
| McVol | 185.670 | ml/mol | McGowan Calculated Property |
| Pc | 2351.92 | kPa | Joback Calculated Property |
| Inp | 1786.00 | NIST | |
| Tboil | 680.31 | K | Joback Calculated Property |
| Tc | 903.22 | K | Joback Calculated Property |
| Tfus | 395.03 | K | Joback Calculated Property |
| Vc | 0.714 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [481.37; 551.84] | J/mol×K | [680.31; 903.22] | 
|
| Cp,gas | 481.37 | J/mol×K | 680.31 | Joback Calculated Property |
| Cp,gas | 495.61 | J/mol×K | 717.46 | Joback Calculated Property |
| Cp,gas | 508.80 | J/mol×K | 754.61 | Joback Calculated Property |
| Cp,gas | 520.99 | J/mol×K | 791.77 | Joback Calculated Property |
| Cp,gas | 532.20 | J/mol×K | 828.92 | Joback Calculated Property |
| Cp,gas | 542.47 | J/mol×K | 866.07 | Joback Calculated Property |
| Cp,gas | 551.84 | J/mol×K | 903.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,6-Difluoro-«alpha»-methylbenzyl alcohol, benzoate.
Sources
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