- InChI
- InChI=1S/C25H28ClF7O4/c1-21-9-7-14(36-20(35)23(27,28)24(29,30)25(31,32)33)11-13(21)3-4-15-16-5-6-18(37-19(34)12-26)22(16,2)10-8-17(15)21/h7,11,15-18H,3-6,8-10,12H2,1-2H3/t15?,16?,17?,18-,21-,22-/m1/s1
- InChI Key
- WYBQRJXFEKTTGH-FSFORYKRSA-N
- Formula
- C25H28ClF7O4
- SMILES
-
CC12CC=C(OC(=O)C(F)(F)C(F)(F)C
(F)(F)F)C=C1CCC1C2CCC2(C)C(OC( =O)CCl)CCC12 - Molecular Weight1
- 560.93
- 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° | -1478.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2120.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.83 | kJ/mol | Joback Calculated Property |
| log10WS | -8.14 | Crippen Calculated Property | |
| logPoct/wat | 6.970 | Crippen Calculated Property | |
| McVol | 350.580 | ml/mol | McGowan Calculated Property |
| Pc | 1033.90 | kPa | Joback Calculated Property |
| Inp | 2795.00 | NIST | |
| Tboil | 994.34 | K | Joback Calculated Property |
| Tc | 1220.42 | K | Joback Calculated Property |
| Tfus | 677.18 | K | Joback Calculated Property |
| Vc | 1.379 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1269.60; 1452.47] | J/mol×K | [994.34; 1220.42] | 
|
| Cp,gas | 1269.60 | J/mol×K | 994.34 | Joback Calculated Property |
| Cp,gas | 1295.66 | J/mol×K | 1032.02 | Joback Calculated Property |
| Cp,gas | 1322.99 | J/mol×K | 1069.70 | Joback Calculated Property |
| Cp,gas | 1351.96 | J/mol×K | 1107.38 | Joback Calculated Property |
| Cp,gas | 1382.94 | J/mol×K | 1145.06 | Joback Calculated Property |
| Cp,gas | 1416.32 | J/mol×K | 1182.74 | Joback Calculated Property |
| Cp,gas | 1452.47 | J/mol×K | 1220.42 | Joback Calculated Property |
Similar Compounds
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Sources
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