- InChI
- InChI=1S/C18H42O7Si4/c1-21-14(15(22-26(2,3)4)17(19)24-28(8,9)10)16(23-27(5,6)7)18(20)25-29(11,12)13/h14-16H,1-13H3
- InChI Key
- KXFQIMOZGZNGBJ-UHFFFAOYSA-N
- Formula
- C18H42O7Si4
- SMILES
-
COC(C(O[Si](C)(C)C)C(=O)O[Si](
C)(C)C)C(O[Si](C)(C)C)C(=O)O[S i](C)(C)C - Molecular Weight1
- 482.86
- 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 | 0.7870 | Relay (... Calculated Property | |
| ΔfG° | -732.21 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1778.24 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 74.46 | kJ/mol | Relay (... Calculated Property |
| IE | 9.71 | eV | Relay (... Calculated Property |
| log10WS | -2.21 | Relay (... Calculated Property | |
| logPoct/wat | 4.198 | Crippen Calculated Property | |
| Pc | 243.65 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1776.00; 1776.00] |
|
|
| Inp | 1776.00 | NIST | |
| Inp | 1776.00 | NIST | |
| Tboil | 569.08 | K | Relay (... Calculated Property |
| Tc | 726.19 | K | Relay (... Calculated Property |
| Tfus | 306.74 | K | Relay (... Calculated Property |
| Vc | 1.539 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 3-O-Methylarabinaric 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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