- InChI
- InChI=1S/C10H10F2O3/c1-2-3-14-10(13)15-9-5-7(11)4-8(12)6-9/h4-6H,2-3H2,1H3
- InChI Key
- OWGIOIYZQQRGHP-UHFFFAOYSA-N
- Formula
- C10H10F2O3
- SMILES
- CCCOC(=O)Oc1cc(F)cc(F)c1
- Molecular Weight1
- 216.18
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -877.97 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 26.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.90 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 2.890 | Crippen Calculated Property | |
| McVol | 144.850 | ml/mol | McGowan Calculated Property |
| Inp | 1247.00 | NIST | |
| Tboil | 495.80 | K | Relay (1.0) Calculated Property |
| Tfus | 255.36 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [336.40; 398.82] | J/mol×K | [544.22; 734.81] | 
|
| Cp,gas | 336.40 | J/mol×K | 544.22 | Joback Calculated Property |
| Cp,gas | 348.20 | J/mol×K | 575.98 | Joback Calculated Property |
| Cp,gas | 359.44 | J/mol×K | 607.75 | Joback Calculated Property |
| Cp,gas | 370.13 | J/mol×K | 639.51 | Joback Calculated Property |
| Cp,gas | 380.26 | J/mol×K | 671.28 | Joback Calculated Property |
| Cp,gas | 389.82 | J/mol×K | 703.04 | Joback Calculated Property |
| Cp,gas | 398.82 | J/mol×K | 734.81 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, propyl 3,5-difluophenyl ester.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
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