- InChI
- InChI=1S/C11H14F2O/c1-2-3-6-14-8-9-7-10(12)4-5-11(9)13/h4-5,7H,2-3,6,8H2,1H3
- InChI Key
- KKYCXJVPKNTKAB-UHFFFAOYSA-N
- Formula
- C11H14F2O
- SMILES
- CCCCOCc1cc(F)ccc1F
- Molecular Weight1
- 200.23
- 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° | -359.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -581.22 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 44.46 | kJ/mol | Joback Calculated Property |
| log10WS | -3.78 | Crippen Calculated Property | |
| logPoct/wat | 3.281 | Crippen Calculated Property | |
| McVol | 151.500 | ml/mol | McGowan Calculated Property |
| Pc | 2311.39 | kPa | Joback Calculated Property |
| Inp | 1252.00 | NIST | |
| Tboil | 508.68 | K | Joback Calculated Property |
| Tc | 692.23 | K | Joback Calculated Property |
| Tfus | 288.60 | K | Joback Calculated Property |
| Vc | 0.598 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [342.96; 415.50] | J/mol×K | [508.68; 692.23] | 
|
| Cp,gas | 342.96 | J/mol×K | 508.68 | Joback Calculated Property |
| Cp,gas | 356.47 | J/mol×K | 539.27 | Joback Calculated Property |
| Cp,gas | 369.40 | J/mol×K | 569.86 | Joback Calculated Property |
| Cp,gas | 381.76 | J/mol×K | 600.46 | Joback Calculated Property |
| Cp,gas | 393.56 | J/mol×K | 631.05 | Joback Calculated Property |
| Cp,gas | 404.80 | J/mol×K | 661.64 | Joback Calculated Property |
| Cp,gas | 415.50 | J/mol×K | 692.23 | Joback Calculated Property |
Similar Compounds
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Sources
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