- InChI
- InChI=1S/C14H11F5OSi/c1-21(2,20-8-6-4-3-5-7-8)14-12(18)10(16)9(15)11(17)13(14)19/h3-7H,1-2H3
- InChI Key
- MOEXGEHFQPNSGK-UHFFFAOYSA-N
- Formula
- C14H11F5OSi
- SMILES
-
C[Si](C)(Oc1ccccc1)c1c(F)c(F)c
(F)c(F)c1F - Molecular Weight1
- 318.31
- CAS
- 71338-91-5
- Other Names
-
- Phenol, FP
- Pentafluorophenyldimethylsilyloxybenzene
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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.
- 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 |
|---|---|---|---|
| ω | 0.5636 | Relay (1.0) Calculated Property | |
| ΔfG° | -687.42 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -881.00 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 68.25 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.06 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.79 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.873 | Crippen Calculated Property | |
| Pc | 1845.60 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1490.00; 1510.00] |
|
|
| Inp | 1490.00 | NIST | |
| Inp | 1510.00 | NIST | |
| Inp | 1510.00 | NIST | |
| Inp | 1490.00 | NIST | |
| Tboil | 530.06 | K | Relay (1.0) Calculated Property |
| Tc | 741.59 | K | Relay (1.0) Calculated Property |
| Tfus | 304.97 | K | Relay (1.0) Calculated Property |
| Vc | 0.742 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Phenol DMPFPS.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- NIST Webbook
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