- InChI
- InChI=1S/C38H92O12Si9/c1-51(2,3)39-28-38(50-59(25,26)27)34(47-56(16,17)18)30(33(46-55(13,14)15)37(42-38)49-58(22,23)24)40-35-31(44-53(7,8)9)29(43-52(4,5)6)32(45-54(10,11)12)36(41-35)48-57(19,20)21/h29-37H,28H2,1-27H3/t29-,30-,31-,32+,33+,34-,35?,36-,37?,38-/m1/s1
- InChI Key
- LQOPGNDLDNFQEW-XPUHEFDISA-N
- Formula
- C38H92O12Si9
- SMILES
-
C[Si](C)(C)OCC1(O[Si](C)(C)C)O
C(O[Si](C)(C)C)C(O[Si](C)(C)C) C(OC2OC(O[Si](C)(C)C)C(O[Si](C )(C)C)C(O[Si](C)(C)C)C2O[Si](C )(C)C)C1O[Si](C)(C)C - Molecular Weight1
- 993.90
- 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 | 1.1289 | Relay (... Calculated Property | |
| ΔfG° | -969.26 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -3234.96 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 99.43 | kJ/mol | Relay (... Calculated Property |
| IE | 9.10 | eV | Relay (... Calculated Property |
| log10WS | -6.60 | Relay (... Calculated Property | |
| logPoct/wat | 10.613 | Crippen Calculated Property | |
| Pc | -2127.13 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [2774.00; 2774.00] |
|
|
| Inp | 2774.00 | NIST | |
| Inp | 2774.00 | NIST | |
| Tboil | 786.31 | K | Relay (... Calculated Property |
| Tc | 929.79 | K | Relay (... Calculated Property |
| Tfus | 306.26 | K | Relay (... Calculated Property |
| Vc | 3.256 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Maltulose-2, TMS («beta»-pyranose).
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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