- InChI
- InChI=1S/C12H16F2O/c1-2-3-4-7-15-9-10-8-11(13)5-6-12(10)14/h5-6,8H,2-4,7,9H2,1H3
- InChI Key
- GUXXEZLCRMKMBH-UHFFFAOYSA-N
- Formula
- C12H16F2O
- SMILES
- CCCCCOCc1cc(F)ccc1F
- Molecular Weight1
- 214.25
- 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° | -351.31 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -601.86 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.45 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.68 | kJ/mol | Joback Calculated Property |
| log10WS | -4.19 | Crippen Calculated Property | |
| logPoct/wat | 3.672 | Crippen Calculated Property | |
| McVol | 165.590 | ml/mol | McGowan Calculated Property |
| Pc | 2111.94 | kPa | Joback Calculated Property |
| Inp | [1351.00; 1351.00] |
|
|
| Inp | 1351.00 | NIST | |
| Inp | 1351.00 | NIST | |
| Tboil | 531.56 | K | Joback Calculated Property |
| Tc | 713.21 | K | Joback Calculated Property |
| Tfus | 299.87 | K | Joback Calculated Property |
| Vc | 0.653 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [389.12; 466.02] | J/mol×K | [531.56; 713.21] |
|
| Cp,gas | 389.12 | J/mol×K | 531.56 | Joback Calculated Property |
| Cp,gas | 403.46 | J/mol×K | 561.84 | Joback Calculated Property |
| Cp,gas | 417.18 | J/mol×K | 592.11 | Joback Calculated Property |
| Cp,gas | 430.29 | J/mol×K | 622.39 | Joback Calculated Property |
| Cp,gas | 442.79 | J/mol×K | 652.66 | Joback Calculated Property |
| Cp,gas | 454.69 | J/mol×K | 682.94 | Joback Calculated Property |
| Cp,gas | 466.02 | J/mol×K | 713.21 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,5-Difluorobenzyl alcohol, n-pentyl.
Sources
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