- InChI
- InChI=1S/C4H5F5O/c1-2(10)3(5,6)4(7,8)9/h2,10H,1H3
- InChI Key
- BUGIAHXXBFVPGW-UHFFFAOYSA-N
- Formula
- C4H5F5O
- SMILES
- CC(O)C(F)(F)C(F)(F)F
- Molecular Weight1
- 164.07
- CAS
- 374-40-3
- Other Names
-
- Pentafluorobutanol-2
- 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).
- 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° | -1124.83 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1281.45 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 7.25 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 34.11 | kJ/mol | Joback Calculated Property |
| log10WS | -1.85 | Crippen Calculated Property | |
| logPoct/wat | 1.565 | Crippen Calculated Property | |
| McVol | 81.940 | ml/mol | McGowan Calculated Property |
| Pc | 3505.43 | kPa | Joback Calculated Property |
| Tboil | 357.00 ± 1.00 | K | NIST |
| Tc | 516.48 | K | Joback Calculated Property |
| Tfus | 188.45 | K | Joback Calculated Property |
| Vc | 0.341 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [178.56; 219.41] | J/mol×K | [372.55; 516.48] | 
|
| Cp,gas | 178.56 | J/mol×K | 372.55 | Joback Calculated Property |
| Cp,gas | 186.44 | J/mol×K | 396.54 | Joback Calculated Property |
| Cp,gas | 193.87 | J/mol×K | 420.53 | Joback Calculated Property |
| Cp,gas | 200.86 | J/mol×K | 444.51 | Joback Calculated Property |
| Cp,gas | 207.44 | J/mol×K | 468.50 | Joback Calculated Property |
| Cp,gas | 213.61 | J/mol×K | 492.49 | Joback Calculated Property |
| Cp,gas | 219.41 | J/mol×K | 516.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3,3,4,4,4-pentafluorobutan-2-ol.
Sources
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