- InChI
- InChI=1S/C17H36O2Si/c1-16(2)14-12-10-8-6-7-9-11-13-15-17(18)19-20(3,4)5/h16H,6-15H2,1-5H3
- InChI Key
- VDEGIVODSVYIDJ-UHFFFAOYSA-N
- Formula
- C17H36O2Si
- SMILES
-
CC(C)CCCCCCCCCCC(=O)O[Si](C)(C
)C - Molecular Weight1
- 300.55
- Other Names
-
- Tridecanoic acid, 12-methyl, trimethylsilyl ester
- 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 | 0.8088 | Relay (... Calculated Property | |
| ΔfG° | -186.79 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -839.16 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 83.02 | kJ/mol | Relay (... Calculated Property |
| IE | 9.92 | eV | Relay (... Calculated Property |
| log10WS | -5.79 | Relay (... Calculated Property | |
| logPoct/wat | 5.921 | Crippen Calculated Property | |
| Pc | 928.74 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1808.00; 1808.00] |
|
|
| Inp | 1808.00 | NIST | |
| Inp | 1808.00 | NIST | |
| Tboil | 555.13 | K | Relay (... Calculated Property |
| Tc | 724.44 | K | Relay (... Calculated Property |
| Tfus | 261.70 | K | Relay (... Calculated Property |
| Vc | 1.101 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Isotetradecanoic acid, TMS.
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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