- InChI
- InChI=1S/C9H19BrO2Si/c1-4-5-6-7-9(11)12-13(2,3)8-10/h4-8H2,1-3H3
- InChI Key
- GDDDIIADSKDSQK-UHFFFAOYSA-N
- Formula
- C9H19BrO2Si
- SMILES
- CCCCCC(=O)O[Si](C)(C)CBr
- Molecular Weight1
- 267.24
- 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 | 0.6251 | Relay (... Calculated Property | |
| ΔfG° | -247.12 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -651.18 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 60.46 | kJ/mol | Relay (... Calculated Property |
| IE | 10.06 | eV | Relay (... Calculated Property |
| log10WS | -3.34 | Relay (... Calculated Property | |
| logPoct/wat | 3.249 | Crippen Calculated Property | |
| Pc | 2019.89 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1365.00; 1365.00] |
|
|
| Inp | 1365.00 | NIST | |
| Inp | 1365.00 | NIST | |
| Tboil | 503.81 | K | Relay (... Calculated Property |
| Tc | 677.11 | K | Relay (... Calculated Property |
| Tfus | 224.24 | K | Relay (... Calculated Property |
| Vc | 0.692 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Hexanoic acid, bromomethyldimethylsilyl ester.
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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