- InChI
- InChI=1S/C15H31BrO2Si/c1-4-5-6-7-8-9-10-11-12-13-15(17)18-19(2,3)14-16/h4-14H2,1-3H3
- InChI Key
- XWKNMBKHQDNTNI-UHFFFAOYSA-N
- Formula
- C15H31BrO2Si
- SMILES
- CCCCCCCCCCCC(=O)O[Si](C)(C)CBr
- Molecular Weight1
- 351.39
- 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 | 0.8426 | Relay (... Calculated Property | |
| ΔfG° | -195.00 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -773.97 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 83.27 | kJ/mol | Relay (... Calculated Property |
| IE | 9.94 | eV | Relay (... Calculated Property |
| log10WS | -5.79 | Relay (... Calculated Property | |
| logPoct/wat | 5.590 | Crippen Calculated Property | |
| Pc | 1295.76 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | 1969.00 | NIST | |
| Tboil | 576.08 | K | Relay (... Calculated Property |
| Tc | 753.05 | K | Relay (... Calculated Property |
| Tfus | 264.40 | K | Relay (... Calculated Property |
| Vc | 1.029 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Dodecanoic 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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