- InChI
- InChI=1S/C16H34O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16(17)18-19(2,3)4/h5-15H2,1-4H3
- InChI Key
- UZUTZCYXYDHJAT-UHFFFAOYSA-N
- Formula
- C16H34O2Si
- SMILES
- CCCCCCCCCCCCC(=O)O[Si](C)(C)C
- Molecular Weight1
- 286.53
- CAS
- 169597-14-2
- Other Names
-
- Tridecanoic acid, TMS
- Tridecanoic acid, trimethylsilyl ester
- Trimethylsilyl tridecanoate
- Tridecanoic acid, tms derivative
- 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 | 0.8015 | Relay (1.0) Calculated Property | |
| ΔfG° | -195.67 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -808.01 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 80.83 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.93 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.49 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.676 | Crippen Calculated Property | |
| Pc | 977.20 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1741.00; 1755.00] |
|
|
| Inp | 1741.00 | NIST | |
| Inp | 1749.00 | NIST | |
| Inp | 1745.90 | NIST | |
| Inp | 1748.00 | NIST | |
| Inp | 1749.00 | NIST | |
| Inp | 1755.00 | NIST | |
| Inp | 1755.00 | NIST | |
| Inp | 1745.90 | NIST | |
| Tboil | 547.42 | K | Relay (1.0) Calculated Property |
| Tc | 714.36 | K | Relay (1.0) Calculated Property |
| Tfus | 266.85 | K | Relay (1.0) Calculated Property |
| Vc | 1.056 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to n-Tridecanoic acid, trimethylsilyl 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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