- InChI
- InChI=1S/C12H4F10O4/c13-9(14,11(18,19)12(20,21)22)7(23)25-5-1-3-6(4-2-5)26-8(24)10(15,16)17/h1-4H
- InChI Key
- RKZQEXQZJYVYMO-UHFFFAOYSA-N
- Formula
- C12H4F10O4
- SMILES
-
O=C(Oc1ccc(OC(=O)C(F)(F)C(F)(F
)C(F)(F)F)cc1)C(F)(F)F - Molecular Weight1
- 402.14
- 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° | -2251.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2551.65 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.20 | kJ/mol | Joback Calculated Property |
| log10WS | -4.89 | Crippen Calculated Property | |
| logPoct/wat | 3.893 | Crippen Calculated Property | |
| McVol | 188.760 | ml/mol | McGowan Calculated Property |
| Pc | 1832.54 | kPa | Joback Calculated Property |
| Inp | 1101.00 | NIST | |
| Tboil | 637.98 | K | Joback Calculated Property |
| Tc | 811.02 | K | Joback Calculated Property |
| Tfus | 423.84 | K | Joback Calculated Property |
| Vc | 0.783 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [530.58; 578.68] | J/mol×K | [637.98; 811.02] | 
|
| Cp,gas | 530.58 | J/mol×K | 637.98 | Joback Calculated Property |
| Cp,gas | 540.46 | J/mol×K | 666.82 | Joback Calculated Property |
| Cp,gas | 549.53 | J/mol×K | 695.66 | Joback Calculated Property |
| Cp,gas | 557.83 | J/mol×K | 724.50 | Joback Calculated Property |
| Cp,gas | 565.43 | J/mol×K | 753.34 | Joback Calculated Property |
| Cp,gas | 572.36 | J/mol×K | 782.18 | Joback Calculated Property |
| Cp,gas | 578.68 | J/mol×K | 811.02 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hudroquinone, TFA-HFB.
Sources
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