- InChI
- InChI=1S/C12H31NO5SSi3/c1-20(2,3)13-11(12(14)17-21(4,5)6)10-19(15,16)18-22(7,8)9/h11,13H,10H2,1-9H3
- InChI Key
- JYOBCXZPYMIDGX-UHFFFAOYSA-N
- Formula
- C12H31NO5SSi3
- SMILES
-
C[Si](C)(C)NC(CS(=O)(=O)O[Si](
C)(C)C)C(=O)O[Si](C)(C)C - Molecular Weight1
- 385.70
- 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 | 0.7291 | Relay (1.0) Calculated Property | |
| ΔfG° | -496.95 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1299.69 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 75.71 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.11 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.29 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.339 | Crippen Calculated Property | |
| Pc | 818.85 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1969.00; 1969.00] |
|
|
| Inp | 1969.00 | NIST | |
| Inp | 1969.00 | NIST | |
| Tboil | 555.34 | K | Relay (1.0) Calculated Property |
| Tc | 765.09 | K | Relay (1.0) Calculated Property |
| Tfus | 349.98 | K | Relay (1.0) Calculated Property |
| Vc | 1.172 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Cysteic 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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