- InChI
- InChI=1S/C10H2Cl3F7O2/c11-3-1-4(12)6(13)5(2-3)22-7(21)8(14,15)9(16,17)10(18,19)20/h1-2H
- InChI Key
- CDIXTPKRHJLRNO-UHFFFAOYSA-N
- Formula
- C10H2Cl3F7O2
- SMILES
-
O=C(Oc1cc(Cl)cc(Cl)c1Cl)C(F)(F
)C(F)(F)C(F)(F)F - Molecular Weight1
- 393.47
- 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° | -1508.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1738.65 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.82 | kJ/mol | Joback Calculated Property |
| log10WS | -5.97 | Crippen Calculated Property | |
| logPoct/wat | 5.385 | Crippen Calculated Property | |
| McVol | 184.550 | ml/mol | McGowan Calculated Property |
| Pc | 2038.23 | kPa | Joback Calculated Property |
| Inp | 1328.00 | NIST | |
| Tboil | 643.60 | K | Joback Calculated Property |
| Tc | 839.91 | K | Joback Calculated Property |
| Tfus | 439.75 | K | Joback Calculated Property |
| Vc | 0.751 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [438.23; 475.92] | J/mol×K | [643.60; 839.91] | 
|
| Cp,gas | 438.23 | J/mol×K | 643.60 | Joback Calculated Property |
| Cp,gas | 446.19 | J/mol×K | 676.32 | Joback Calculated Property |
| Cp,gas | 453.41 | J/mol×K | 709.04 | Joback Calculated Property |
| Cp,gas | 459.93 | J/mol×K | 741.76 | Joback Calculated Property |
| Cp,gas | 465.81 | J/mol×K | 774.47 | Joback Calculated Property |
| Cp,gas | 471.12 | J/mol×K | 807.19 | Joback Calculated Property |
| Cp,gas | 475.92 | J/mol×K | 839.91 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,3,5-Trichlorophenol, O-heptafluorobutyryl-.
Sources
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