- InChI
- InChI=1S/C8H2ClF5O2/c9-1-2(15)16-8-6(13)4(11)3(10)5(12)7(8)14/h1H2
- InChI Key
- VVKNQIGLUQLDPD-UHFFFAOYSA-N
- Formula
- C8H2ClF5O2
- SMILES
- O=C(CCl)Oc1c(F)c(F)c(F)c(F)c1F
- Molecular Weight1
- 260.55
- 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° | -1139.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1270.36 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.44 | kJ/mol | Joback Calculated Property |
| log10WS | -3.60 | Crippen Calculated Property | |
| logPoct/wat | 2.526 | Crippen Calculated Property | |
| McVol | 128.350 | ml/mol | McGowan Calculated Property |
| Pc | 2640.67 | kPa | Joback Calculated Property |
| Inp | 1151.00 | NIST | |
| Tboil | 544.09 | K | Joback Calculated Property |
| Tc | 724.72 | K | Joback Calculated Property |
| Tfus | 373.97 | K | Joback Calculated Property |
| Vc | 0.538 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [275.92; 313.76] | J/mol×K | [544.09; 724.72] | 
|
| Cp,gas | 275.92 | J/mol×K | 544.09 | Joback Calculated Property |
| Cp,gas | 282.94 | J/mol×K | 574.20 | Joback Calculated Property |
| Cp,gas | 289.68 | J/mol×K | 604.30 | Joback Calculated Property |
| Cp,gas | 296.14 | J/mol×K | 634.41 | Joback Calculated Property |
| Cp,gas | 302.32 | J/mol×K | 664.51 | Joback Calculated Property |
| Cp,gas | 308.19 | J/mol×K | 694.62 | Joback Calculated Property |
| Cp,gas | 313.76 | J/mol×K | 724.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Chloroacetic acid, pentafluorophenyl ester.
Sources
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