- InChI
- InChI=1S/C11H7F9O7/c12-9(13,14)6(21)25-3-1-5(27-8(23)11(18,19)20)24-2-4(3)26-7(22)10(15,16)17/h3-5H,1-2H2
- InChI Key
- RHUZEBNZNRQOPD-UHFFFAOYSA-N
- Formula
- C11H7F9O7
- SMILES
-
O=C(OC1CC(OC(=O)C(F)(F)F)C(OC(
=O)C(F)(F)F)CO1)C(F)(F)F - Molecular Weight1
- 422.15
- 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° | -2481.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2914.37 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.04 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.63 | kJ/mol | Joback Calculated Property |
| log10WS | -2.82 | Crippen Calculated Property | |
| logPoct/wat | 1.786 | Crippen Calculated Property | |
| McVol | 199.110 | ml/mol | McGowan Calculated Property |
| Pc | 1804.63 | kPa | Joback Calculated Property |
| Inp | 1110.50 | NIST | |
| Tboil | 700.85 | K | Joback Calculated Property |
| Tc | 876.65 | K | Joback Calculated Property |
| Tfus | 468.25 | K | Joback Calculated Property |
| Vc | 0.804 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [617.48; 672.93] | J/mol×K | [700.85; 876.65] | 
|
| Cp,gas | 617.48 | J/mol×K | 700.85 | Joback Calculated Property |
| Cp,gas | 628.80 | J/mol×K | 730.15 | Joback Calculated Property |
| Cp,gas | 639.26 | J/mol×K | 759.45 | Joback Calculated Property |
| Cp,gas | 648.89 | J/mol×K | 788.75 | Joback Calculated Property |
| Cp,gas | 657.69 | J/mol×K | 818.05 | Joback Calculated Property |
| Cp,gas | 665.70 | J/mol×K | 847.35 | Joback Calculated Property |
| Cp,gas | 672.93 | J/mol×K | 876.65 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Deoxy-D-ribopyranose, tris(trifluoroacetate) (isomer 1).
Sources
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