- InChI
- InChI=1S/C3HF5O/c4-2(5)1(9)3(6,7)8/h2H
- InChI Key
- WQAWXRFLNDAOON-UHFFFAOYSA-N
- Formula
- C3HF5O
- SMILES
- O=C(C(F)F)C(F)(F)F
- Molecular Weight1
- 148.03
- CAS
- 431-71-0
- Other Names
-
- Pentafluoroacetone
- 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° | -1128.19 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1212.41 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 23.25 | kJ/mol | Joback Calculated Property |
| log10WS | -1.33 | Crippen Calculated Property | |
| logPoct/wat | 1.383 | Crippen Calculated Property | |
| McVol | 63.550 | ml/mol | McGowan Calculated Property |
| Pc | 3713.49 | kPa | Joback Calculated Property |
| Tboil | 314.59 | K | Joback Calculated Property |
| Tc | 460.65 | K | Joback Calculated Property |
| Tfus | 163.87 | K | Joback Calculated Property |
| Vc | 0.282 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [120.05; 150.88] | J/mol×K | [314.59; 460.65] | 
|
| Cp,gas | 120.05 | J/mol×K | 314.59 | Joback Calculated Property |
| Cp,gas | 125.93 | J/mol×K | 338.93 | Joback Calculated Property |
| Cp,gas | 131.50 | J/mol×K | 363.28 | Joback Calculated Property |
| Cp,gas | 136.77 | J/mol×K | 387.62 | Joback Calculated Property |
| Cp,gas | 141.75 | J/mol×K | 411.96 | Joback Calculated Property |
| Cp,gas | 146.45 | J/mol×K | 436.31 | Joback Calculated Property |
| Cp,gas | 150.88 | J/mol×K | 460.65 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Propanone, 1,1,1,3,3-pentafluoro-.
Sources
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