- InChI
- InChI=1S/C14H22O3Si/c1-14(2,3)18(5,6)17-13(15)11-7-9-12(16-4)10-8-11/h7-10H,1-6H3
- InChI Key
- CSDAFUDOYGPYMF-UHFFFAOYSA-N
- Formula
- C14H22O3Si
- SMILES
-
COc1ccc(C(=O)O[Si](C)(C)C(C)(C
)C)cc1 - Molecular Weight1
- 266.41
- 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 | 0.6358 | Relay (1.0) Calculated Property | |
| ΔfG° | -189.75 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -629.22 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 72.87 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.32 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.81 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.857 | Crippen Calculated Property | |
| Pc | 1816.35 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1777.00; 1777.00] |
|
|
| Inp | 1777.00 | NIST | |
| Inp | 1777.00 | NIST | |
| Tboil | 572.20 | K | Relay (1.0) Calculated Property |
| Tc | 776.02 | K | Relay (1.0) Calculated Property |
| Tfus | 346.91 | K | Relay (1.0) Calculated Property |
| Vc | 0.799 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Benzoic acid, 4-methoxy-, tert.-butyldimethylsilyl 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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