- InChI
- InChI=1S/C18H28F6O4/c1-4-5-6-7-8-9-10-11-27-14(25)16(2,3)15(26)28-12-17(20,21)13(19)18(22,23)24/h13H,4-12H2,1-3H3
- InChI Key
- MRADZBZJACRLEP-UHFFFAOYSA-N
- Formula
- C18H28F6O4
- SMILES
-
CCCCCCCCCOC(=O)C(C)(C)C(=O)OCC
(F)(F)C(F)C(F)(F)F - Molecular Weight1
- 422.40
- 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° | -1529.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2112.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.80 | kJ/mol | Joback Calculated Property |
| log10WS | -5.78 | Crippen Calculated Property | |
| logPoct/wat | 5.385 | Crippen Calculated Property | |
| McVol | 289.980 | ml/mol | McGowan Calculated Property |
| Pc | 1068.66 | kPa | Joback Calculated Property |
| Inp | 1716.00 | NIST | |
| Tboil | 749.31 | K | Joback Calculated Property |
| Tc | 921.08 | K | Joback Calculated Property |
| Tfus | 432.74 | K | Joback Calculated Property |
| Vc | 1.161 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [900.65; 981.89] | J/mol×K | [749.31; 921.08] | 
|
| Cp,gas | 900.65 | J/mol×K | 749.31 | Joback Calculated Property |
| Cp,gas | 916.32 | J/mol×K | 777.94 | Joback Calculated Property |
| Cp,gas | 931.07 | J/mol×K | 806.57 | Joback Calculated Property |
| Cp,gas | 944.96 | J/mol×K | 835.20 | Joback Calculated Property |
| Cp,gas | 958.03 | J/mol×K | 863.82 | Joback Calculated Property |
| Cp,gas | 970.33 | J/mol×K | 892.45 | Joback Calculated Property |
| Cp,gas | 981.89 | J/mol×K | 921.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, 2,2,3,4,4,4-hexafluorobutyl nonyl ester.
Sources
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