- InChI
- InChI=1S/C27H56O3Si/c1-8-9-10-11-12-13-14-15-16-17-18-19-22-25(23-20-21-24-26(28)29-5)30-31(6,7)27(2,3)4/h25H,8-24H2,1-7H3
- InChI Key
- JBJDUECARVBNET-UHFFFAOYSA-N
- Formula
- C27H56O3Si
- SMILES
-
CCCCCCCCCCCCCCC(CCCCC(=O)OC)O[
Si](C)(C)C(C)(C)C - Molecular Weight1
- 456.82
- 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 | 1.0822 | Relay (... Calculated Property | |
| ΔfG° | -164.35 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1106.93 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 113.12 | kJ/mol | Relay (... Calculated Property |
| IE | 9.28 | eV | Relay (... Calculated Property |
| log10WS | -7.05 | Relay (... Calculated Property | |
| logPoct/wat | 9.201 | Crippen Calculated Property | |
| Pc | 428.28 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [2739.00; 2739.00] |
|
|
| Inp | 2739.00 | NIST | |
| Inp | 2739.00 | NIST | |
| Tboil | 637.59 | K | Relay (... Calculated Property |
| Tc | 830.31 | K | Relay (... Calculated Property |
| Tfus | 283.66 | K | Relay (... Calculated Property |
| Vc | 1.622 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 6-Hydroxy-arachidic, methyl ester, tBDMS ether.
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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