- InChI
- InChI=1S/C28H66O9Si6/c1-38(2,3)31-21-23(25(35-41(10,11)12)22(19-29)33-39(4,5)6)32-28-27(37-43(16,17)18)26(36-42(13,14)15)24(20-30-28)34-40(7,8)9/h19,22-28H,20-21H2,1-18H3/t22-,23+,24+,25+,26-,27+,28-/m1/s1
- InChI Key
- FNKUSCCBLBUZFF-FHUOLJJNSA-N
- Formula
- C28H66O9Si6
- SMILES
-
C[Si](C)(C)OCC(OC1OCC(O[Si](C)
(C)C)C(O[Si](C)(C)C)C1O[Si](C) (C)C)C(O[Si](C)(C)C)C(C=O)O[Si ](C)(C)C - Molecular Weight1
- 715.33
- 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 | 0.9465 | Relay (... Calculated Property | |
| ΔfG° | -691.09 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -2279.69 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 92.93 | kJ/mol | Relay (... Calculated Property |
| IE | 9.24 | eV | Relay (... Calculated Property |
| log10WS | -3.78 | Relay (... Calculated Property | |
| logPoct/wat | 6.879 | Crippen Calculated Property | |
| Pc | -633.14 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [2403.10; 2403.10] |
|
|
| Inp | 2403.10 | NIST | |
| Inp | 2403.10 | NIST | |
| Tboil | 710.09 | K | Relay (... Calculated Property |
| Tc | 859.12 | K | Relay (... Calculated Property |
| Tfus | 319.89 | K | Relay (... Calculated Property |
| Vc | 2.304 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to XYLOBIOSE 6TMS-1.
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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