- InChI
- InChI=1S/C10H3Cl2F15O2/c11-2(12)1-29-3(28)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)9(23,24)10(25,26)27/h2H,1H2
- InChI Key
- JRIWQWPDYOLSAY-UHFFFAOYSA-N
- Formula
- C10H3Cl2F15O2
- SMILES
-
O=C(OCC(Cl)Cl)C(F)(F)C(F)(F)C(
F)(F)C(F)(F)C(F)(F)C(F)(F)C(F) (F)F - Molecular Weight1
- 511.01
- 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° | -3129.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -3534.19 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.62 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 34.06 | kJ/mol | Joback Calculated Property |
| log10WS | -6.33 | Crippen Calculated Property | |
| logPoct/wat | 5.707 | Crippen Calculated Property | |
| McVol | 210.230 | ml/mol | McGowan Calculated Property |
| Pc | 1331.98 | kPa | Joback Calculated Property |
| Inp | [1053.00; 1053.00] |
|
|
| Inp | 1053.00 | NIST | |
| Inp | 1053.00 | NIST | |
| Tboil | 545.35 | K | Joback Calculated Property |
| Tc | 688.71 | K | Joback Calculated Property |
| Tfus | 345.25 | K | Joback Calculated Property |
| Vc | 0.904 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [573.80; 625.44] | J/mol×K | [545.35; 688.71] |
|
| Cp,gas | 573.80 | J/mol×K | 545.35 | Joback Calculated Property |
| Cp,gas | 584.44 | J/mol×K | 569.24 | Joback Calculated Property |
| Cp,gas | 594.20 | J/mol×K | 593.14 | Joback Calculated Property |
| Cp,gas | 603.13 | J/mol×K | 617.03 | Joback Calculated Property |
| Cp,gas | 611.27 | J/mol×K | 640.92 | Joback Calculated Property |
| Cp,gas | 618.69 | J/mol×K | 664.82 | Joback Calculated Property |
| Cp,gas | 625.44 | J/mol×K | 688.71 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pentadecafluorooctanoic acid, 2,2-dichloroethyl ester.
Sources
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