- InChI
- InChI=1S/C11H10F2O2/c12-8-4-9(13)6-10(5-8)15-11(14)7-2-1-3-7/h4-7H,1-3H2
- InChI Key
- XWXGISDKVLWMRR-UHFFFAOYSA-N
- Formula
- C11H10F2O2
- SMILES
- O=C(Oc1cc(F)cc(F)c1)C1CCC1
- Molecular Weight1
- 212.19
- 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 | 0.5440 | Relay (1.0) Calculated Property | |
| ΔfG° | -440.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -657.09 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.99 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.18 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.98 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.670 | Crippen Calculated Property | |
| McVol | 142.210 | ml/mol | McGowan Calculated Property |
| Pc | 2884.30 | kPa | Joback Calculated Property |
| Inp | 1329.00 | NIST | |
| Tboil | 514.53 | K | Relay (1.0) Calculated Property |
| Tc | 754.13 | K | Relay (1.0) Calculated Property |
| Tfus | 305.72 | K | Relay (1.0) Calculated Property |
| Vc | 0.534 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [348.26; 419.64] | J/mol×K | [573.56; 786.44] | 
|
| Cp,gas | 348.26 | J/mol×K | 573.56 | Joback Calculated Property |
| Cp,gas | 362.22 | J/mol×K | 609.04 | Joback Calculated Property |
| Cp,gas | 375.31 | J/mol×K | 644.52 | Joback Calculated Property |
| Cp,gas | 387.57 | J/mol×K | 680.00 | Joback Calculated Property |
| Cp,gas | 399.03 | J/mol×K | 715.48 | Joback Calculated Property |
| Cp,gas | 409.71 | J/mol×K | 750.96 | Joback Calculated Property |
| Cp,gas | 419.64 | J/mol×K | 786.44 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclobutanecarboxylic acid, 3,5-difluorophenyl ester.
Sources
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