- InChI
- InChI=1S/C17H20ClF5O2/c18-9-7-5-3-1-2-4-6-8-10-25-17(24)11-12(19)14(21)16(23)15(22)13(11)20/h1-10H2
- InChI Key
- ZKMAZQLQJOWAHS-UHFFFAOYSA-N
- Formula
- C17H20ClF5O2
- SMILES
-
O=C(OCCCCCCCCCCCl)c1c(F)c(F)c(
F)c(F)c1F - Molecular Weight1
- 386.79
- 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° | -1063.38 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1456.12 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 54.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.48 | kJ/mol | Joback Calculated Property |
| log10WS | -7.29 | Crippen Calculated Property | |
| logPoct/wat | 5.899 | Crippen Calculated Property | |
| McVol | 255.160 | ml/mol | McGowan Calculated Property |
| Pc | 1266.45 | kPa | Joback Calculated Property |
| Inp | [2124.00; 2124.00] |
|
|
| Inp | 2124.00 | NIST | |
| Inp | 2124.00 | NIST | |
| Tboil | 750.01 | K | Joback Calculated Property |
| Tc | 926.79 | K | Joback Calculated Property |
| Tfus | 475.40 | K | Joback Calculated Property |
| Vc | 1.042 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [721.06; 791.75] | J/mol×K | [750.01; 926.79] |
|
| Cp,gas | 721.06 | J/mol×K | 750.01 | Joback Calculated Property |
| Cp,gas | 734.62 | J/mol×K | 779.47 | Joback Calculated Property |
| Cp,gas | 747.45 | J/mol×K | 808.94 | Joback Calculated Property |
| Cp,gas | 759.57 | J/mol×K | 838.40 | Joback Calculated Property |
| Cp,gas | 770.99 | J/mol×K | 867.86 | Joback Calculated Property |
| Cp,gas | 781.71 | J/mol×K | 897.33 | Joback Calculated Property |
| Cp,gas | 791.75 | J/mol×K | 926.79 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 10-Chlorodecyl 2,3,4,5,6-pentafluorobenzoate.
Sources
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