- InChI
- InChI=1S/C4HF7O/c5-2(6,1-12)3(7,8)4(9,10)11/h1H
- InChI Key
- IQJZGNJYXIIMGP-UHFFFAOYSA-N
- Formula
- C4HF7O
- SMILES
- O=CC(F)(F)C(F)(F)C(F)(F)F
- Molecular Weight1
- 198.04
- CAS
- 375-02-0
- Other Names
-
- Butyraldehyde, heptafluoro-
- Heptafluorobutyraldehyde
- Perfluorobutyraldehyde
- Heptafluoro-n-butyraldehyde
- 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° | -1471.87 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1610.49 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 7.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 21.61 | kJ/mol | Joback Calculated Property |
| log10WS | -2.07 | Crippen Calculated Property | |
| logPoct/wat | 2.018 | Crippen Calculated Property | |
| McVol | 81.180 | ml/mol | McGowan Calculated Property |
| Pc | 3135.00 | kPa | Joback Calculated Property |
| Tboil | [302.00; 368.50] | K |
|
| Tboil | 368.50 ± 0.50 | K | NIST |
| Tboil | 302.00 ± 4.00 | K | NIST |
| Tc | 466.28 | K | Joback Calculated Property |
| Tfus | 188.23 | K | Joback Calculated Property |
| Vc | 0.369 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [169.37; 213.12] | J/mol×K | [324.78; 466.28] |
|
| Cp,gas | 169.37 | J/mol×K | 324.78 | Joback Calculated Property |
| Cp,gas | 178.01 | J/mol×K | 348.36 | Joback Calculated Property |
| Cp,gas | 186.09 | J/mol×K | 371.95 | Joback Calculated Property |
| Cp,gas | 193.61 | J/mol×K | 395.53 | Joback Calculated Property |
| Cp,gas | 200.61 | J/mol×K | 419.11 | Joback Calculated Property |
| Cp,gas | 207.10 | J/mol×K | 442.70 | Joback Calculated Property |
| Cp,gas | 213.12 | J/mol×K | 466.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Butanal, heptafluoro-.
Sources
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