- InChI
- InChI=1S/C15H12F16O4/c16-8(17)12(24,25)14(28,29)10(20,21)4-34-6(32)2-1-3-7(33)35-5-11(22,23)15(30,31)13(26,27)9(18)19/h8-9H,1-5H2
- InChI Key
- XCUIUACVMRRNFF-UHFFFAOYSA-N
- Formula
- C15H12F16O4
- SMILES
-
O=C(CCCC(=O)OCC(F)(F)C(F)(F)C(
F)(F)C(F)F)OCC(F)(F)C(F)(F)C(F )(F)C(F)F - Molecular Weight1
- 560.23
- 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° | -3497.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -4043.35 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.67 | kJ/mol | Joback Calculated Property |
| log10WS | -6.34 | Crippen Calculated Property | |
| logPoct/wat | 5.585 | Crippen Calculated Property | |
| McVol | 265.410 | ml/mol | McGowan Calculated Property |
| Pc | 1003.98 | kPa | Joback Calculated Property |
| Inp | [1556.00; 1556.00] |
|
|
| Inp | 1556.00 | NIST | |
| Inp | 1556.00 | NIST | |
| Tboil | 663.24 | K | Joback Calculated Property |
| Tc | 812.76 | K | Joback Calculated Property |
| Tfus | 397.09 | K | Joback Calculated Property |
| Vc | 1.133 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [819.77; 881.77] | J/mol×K | [663.24; 812.76] |
|
| Cp,gas | 819.77 | J/mol×K | 663.24 | Joback Calculated Property |
| Cp,gas | 832.03 | J/mol×K | 688.16 | Joback Calculated Property |
| Cp,gas | 843.45 | J/mol×K | 713.08 | Joback Calculated Property |
| Cp,gas | 854.09 | J/mol×K | 738.00 | Joback Calculated Property |
| Cp,gas | 863.98 | J/mol×K | 762.92 | Joback Calculated Property |
| Cp,gas | 873.19 | J/mol×K | 787.84 | Joback Calculated Property |
| Cp,gas | 881.77 | J/mol×K | 812.76 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, di(2,2,3,3,4,4,5,5-octafluoropentyl) ester.
Sources
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