- InChI
- InChI=1S/C10H20N2OSSi/c1-7(2)8-9(13-15(4,5)6)12(3)10(14)11-8/h7H,1-6H3,(H,11,14)
- InChI Key
- IKHWODBRZLLILN-UHFFFAOYSA-N
- Formula
- C10H20N2OSSi
- SMILES
-
CC(C)c1[nH]c(=S)n(C)c1O[Si](C)
(C)C - Molecular Weight1
- 244.43
- 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 | 0.5542 | Relay (1.0) Calculated Property | |
| ΔfG° | 92.86 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -329.66 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 92.48 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.63 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.35 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.938 | Crippen Calculated Property | |
| Pc | 1778.94 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 1561.00 | NIST | |
| Tboil | 558.54 | K | Relay (1.0) Calculated Property |
| Tc | 776.39 | K | Relay (1.0) Calculated Property |
| Tfus | 388.81 | K | Relay (1.0) Calculated Property |
| Vc | 0.740 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Valine, MTH-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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