- InChI
- InChI=1S/C24H42O4Si2/c1-21(2,3)29(22(4,5)6)25-16-20(28-29)17-13-14-18-19(15-17)27-30(26-18,23(7,8)9)24(10,11)12/h13-15,20H,16H2,1-12H3
- InChI Key
- XBDPEQALEOHOLT-UHFFFAOYSA-N
- Formula
- C24H42O4Si2
- SMILES
-
CC(C)(C)[Si]1(C(C)(C)C)Oc2ccc(
C3CO[Si](C(C)(C)C)(C(C)(C)C)O3 )cc2O1 - Molecular Weight1
- 450.76
- 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 | 0.7156 | Relay (... Calculated Property | |
| ΔfG° | -146.85 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -941.73 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 79.22 | kJ/mol | Relay (... Calculated Property |
| IE | 7.68 | eV | Relay (... Calculated Property |
| log10WS | -5.60 | Relay (... Calculated Property | |
| logPoct/wat | 7.630 | Crippen Calculated Property | |
| Pc | 803.47 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [2465.00; 2465.00] |
|
|
| Inp | 2465.00 | NIST | |
| Inp | 2465.00 | NIST | |
| Tboil | 627.53 | K | Relay (... Calculated Property |
| Tc | 914.01 | K | Relay (... Calculated Property |
| Tfus | 432.99 | K | Relay (... Calculated Property |
| Vc | 1.480 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Ethanediol, 1-(3,4-dihydroxyphenyl), bis-DTBS.
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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