- InChI
- InChI=1S/C15H12BrF5OSi/c1-23(2,22-7-8-5-3-4-6-9(8)16)15-13(20)11(18)10(17)12(19)14(15)21/h3-6H,7H2,1-2H3
- InChI Key
- BKJFRXNKENQHQO-UHFFFAOYSA-N
- Formula
- C15H12BrF5OSi
- SMILES
-
C[Si](C)(OCc1ccccc1Br)c1c(F)c(
F)c(F)c(F)c1F - Molecular Weight1
- 411.24
- 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 | 0.6217 | Relay (1.0) Calculated Property | |
| ΔfG° | -684.75 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -858.02 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 82.16 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.08 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.18 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.774 | Crippen Calculated Property | |
| Pc | 1679.41 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1882.00; 1882.00] |
|
|
| Inp | 1882.00 | NIST | |
| Inp | 1882.00 | NIST | |
| Tboil | 580.13 | K | Relay (1.0) Calculated Property |
| Tc | 785.30 | K | Relay (1.0) Calculated Property |
| Tfus | 300.35 | K | Relay (1.0) Calculated Property |
| Vc | 0.836 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to (2-Bromophenyl)methanol, dimethylpentafluorophenylsilyl ether.
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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