- InChI
- InChI=1S/C11H12F4O/c1-2-3-4-16-6-7-5-8(12)10(14)11(15)9(7)13/h5H,2-4,6H2,1H3
- InChI Key
- XYPXCYPFCFHOHF-UHFFFAOYSA-N
- Formula
- C11H12F4O
- SMILES
- CCCCOCc1cc(F)c(F)c(F)c1F
- Molecular Weight1
- 236.21
- 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° | -768.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -996.38 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 44.15 | kJ/mol | Joback Calculated Property |
| log10WS | -4.44 | Crippen Calculated Property | |
| logPoct/wat | 3.560 | Crippen Calculated Property | |
| McVol | 155.040 | ml/mol | McGowan Calculated Property |
| Pc | 2066.12 | kPa | Joback Calculated Property |
| Inp | 1224.00 | NIST | |
| Tboil | 517.18 | K | Joback Calculated Property |
| Tc | 686.50 | K | Joback Calculated Property |
| Tfus | 314.82 | K | Joback Calculated Property |
| Vc | 0.633 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [359.96; 424.07] | J/mol×K | [517.18; 686.50] | 
|
| Cp,gas | 359.96 | J/mol×K | 517.18 | Joback Calculated Property |
| Cp,gas | 371.72 | J/mol×K | 545.40 | Joback Calculated Property |
| Cp,gas | 383.04 | J/mol×K | 573.62 | Joback Calculated Property |
| Cp,gas | 393.94 | J/mol×K | 601.84 | Joback Calculated Property |
| Cp,gas | 404.41 | J/mol×K | 630.06 | Joback Calculated Property |
| Cp,gas | 414.45 | J/mol×K | 658.28 | Joback Calculated Property |
| Cp,gas | 424.07 | J/mol×K | 686.50 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,3,4,5-Tetrafluorobenzyl alcohol, n-butyl ether.
Sources
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