![4,4'-Bis[2-hydroxyhexafluoroisopropyl]diphenyl ether](/cid/97-361-4/4-4-Bis-2-hydroxyhexafluoroisopropyl-diphenyl-ether.png "4,4'-Bis[2-hydroxyhexafluoroisopropyl]diphenyl ether")
- InChI
- InChI=1S/C18H10F12O3/c19-15(20,21)13(31,16(22,23)24)9-1-5-11(6-2-9)33-12-7-3-10(4-8-12)14(32,17(25,26)27)18(28,29)30/h1-8,31-32H
- InChI Key
- PRBPSTYDUVSNOK-UHFFFAOYSA-N
- Formula
- C18H10F12O3
- SMILES
-
OC(c1ccc(Oc2ccc(C(O)(C(F)(F)F)
C(F)(F)F)cc2)cc1)(C(F)(F)F)C(F )(F)F - Molecular Weight1
- 502.25
- CAS
- 2093-04-1
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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).
- 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 |
|---|---|---|---|
| ω | 0.9239 | Relay (1.0) Calculated Property | |
| ΔfG° | -2393.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2795.66 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 31.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 124.39 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.67 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.08 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.103 | Crippen Calculated Property | |
| McVol | 255.810 | ml/mol | McGowan Calculated Property |
| Pc | 1510.50 | kPa | Joback Calculated Property |
| Tboil | 596.52 | K | Relay (1.0) Calculated Property |
| Tc | 868.25 | K | Relay (1.0) Calculated Property |
| Tfus | 385.30 | K | Relay (1.0) Calculated Property |
| Vc | 0.977 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [818.85; 864.15] | J/mol×K | [853.20; 1045.14] | 
|
| Cp,gas | 818.85 | J/mol×K | 853.20 | Joback Calculated Property |
| Cp,gas | 827.43 | J/mol×K | 885.19 | Joback Calculated Property |
| Cp,gas | 835.43 | J/mol×K | 917.18 | Joback Calculated Property |
| Cp,gas | 842.97 | J/mol×K | 949.17 | Joback Calculated Property |
| Cp,gas | 850.18 | J/mol×K | 981.16 | Joback Calculated Property |
| Cp,gas | 857.20 | J/mol×K | 1013.15 | Joback Calculated Property |
| Cp,gas | 864.15 | J/mol×K | 1045.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4,4'-Bis[2-hydroxyhexafluoroisopropyl]diphenyl ether.
Sources
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