- InChI
- InChI=1S/C8Cl5F3O2/c9-1-2(10)4(12)6(5(13)3(1)11)18-7(17)8(14,15)16
- InChI Key
- QACUOWCDCMROJT-UHFFFAOYSA-N
- Formula
- C8Cl5F3O2
- SMILES
-
O=C(Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1C
l)C(F)(F)F - Molecular Weight1
- 362.35
- 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° | -794.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -949.85 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.32 | kJ/mol | Joback Calculated Property |
| log10WS | -5.87 | Crippen Calculated Property | |
| logPoct/wat | 5.421 | Crippen Calculated Property | |
| McVol | 173.770 | ml/mol | McGowan Calculated Property |
| Pc | 2537.93 | kPa | Joback Calculated Property |
| Inp | [1560.00; 1560.00] |
|
|
| Inp | 1560.00 | NIST | |
| Inp | 1560.00 | NIST | |
| Tboil | 692.04 | K | Joback Calculated Property |
| Tc | 917.09 | K | Joback Calculated Property |
| Tfus | 494.89 | K | Joback Calculated Property |
| Vc | 0.688 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [338.56; 364.39] | J/mol×K | [692.04; 917.09] |
|
| Cp,gas | 338.56 | J/mol×K | 692.04 | Joback Calculated Property |
| Cp,gas | 344.08 | J/mol×K | 729.55 | Joback Calculated Property |
| Cp,gas | 349.09 | J/mol×K | 767.06 | Joback Calculated Property |
| Cp,gas | 353.60 | J/mol×K | 804.56 | Joback Calculated Property |
| Cp,gas | 357.65 | J/mol×K | 842.07 | Joback Calculated Property |
| Cp,gas | 361.24 | J/mol×K | 879.58 | Joback Calculated Property |
| Cp,gas | 364.39 | J/mol×K | 917.09 | Joback Calculated Property |
Similar Compounds
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Sources
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