- InChI
- InChI=1S/C9H8F2O3/c1-2-13-9(12)14-8-4-6(10)3-7(11)5-8/h3-5H,2H2,1H3
- InChI Key
- JNQNBNWVOCKDKL-UHFFFAOYSA-N
- Formula
- C9H8F2O3
- SMILES
- CCOC(=O)Oc1cc(F)cc(F)c1
- Molecular Weight1
- 202.15
- 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° | -610.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -784.74 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.16 | kJ/mol | Joback Calculated Property |
| log10WS | -2.93 | Crippen Calculated Property | |
| logPoct/wat | 2.500 | Crippen Calculated Property | |
| McVol | 130.760 | ml/mol | McGowan Calculated Property |
| Pc | 2947.28 | kPa | Joback Calculated Property |
| Inp | [1169.00; 1169.00] |
|
|
| Inp | 1169.00 | NIST | |
| Inp | 1169.00 | NIST | |
| Tboil | 539.21 | K | Joback Calculated Property |
| Tc | 734.87 | K | Joback Calculated Property |
| Tfus | 338.22 | K | Joback Calculated Property |
| Vc | 0.509 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [295.10; 351.57] | J/mol×K | [539.21; 734.87] |
|
| Cp,gas | 295.10 | J/mol×K | 539.21 | Joback Calculated Property |
| Cp,gas | 305.69 | J/mol×K | 571.82 | Joback Calculated Property |
| Cp,gas | 315.81 | J/mol×K | 604.43 | Joback Calculated Property |
| Cp,gas | 325.47 | J/mol×K | 637.04 | Joback Calculated Property |
| Cp,gas | 334.66 | J/mol×K | 669.65 | Joback Calculated Property |
| Cp,gas | 343.36 | J/mol×K | 702.26 | Joback Calculated Property |
| Cp,gas | 351.57 | J/mol×K | 734.87 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, ethyl 3,5-difluophenyl ester.
Sources
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