- InChI
- InChI=1S/C10H6F2O3/c1-2-3-14-10(13)15-9-5-7(11)4-8(12)6-9/h1,4-6H,3H2
- InChI Key
- DFPDNMFLPHKJON-UHFFFAOYSA-N
- Formula
- C10H6F2O3
- SMILES
- C#CCOC(=O)Oc1cc(F)cc(F)c1
- Molecular Weight1
- 212.15
- 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).
- 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 |
|---|---|---|---|
| ω | 0.5638 | Relay (1.0) Calculated Property | |
| ΔfG° | -379.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -590.19 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.03 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.93 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.34 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.82 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.113 | Crippen Calculated Property | |
| McVol | 136.250 | ml/mol | McGowan Calculated Property |
| Pc | 3121.00 | kPa | Joback Calculated Property |
| Inp | [1249.00; 1249.00] |
|
|
| Inp | 1249.00 | NIST | |
| Inp | 1249.00 | NIST | |
| Tboil | 507.93 | K | Relay (1.0) Calculated Property |
| Tc | 700.24 | K | Relay (1.0) Calculated Property |
| Tfus | 286.01 | K | Relay (1.0) Calculated Property |
| Vc | 0.490 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [302.59; 355.12] | J/mol×K | [552.21; 758.28] |
|
| Cp,gas | 302.59 | J/mol×K | 552.21 | Joback Calculated Property |
| Cp,gas | 312.62 | J/mol×K | 586.55 | Joback Calculated Property |
| Cp,gas | 322.14 | J/mol×K | 620.90 | Joback Calculated Property |
| Cp,gas | 331.15 | J/mol×K | 655.24 | Joback Calculated Property |
| Cp,gas | 339.65 | J/mol×K | 689.59 | Joback Calculated Property |
| Cp,gas | 347.64 | J/mol×K | 723.93 | Joback Calculated Property |
| Cp,gas | 355.12 | J/mol×K | 758.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, propargyl 3,5-difluophenyl ester.
Sources
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