- InChI
- InChI=1S/C13H18ClNOSi/c1-17(2,10-14)16-8-7-11-9-15-13-6-4-3-5-12(11)13/h3-6,9,15H,7-8,10H2,1-2H3
- InChI Key
- WKPVGOJSHZTWRO-UHFFFAOYSA-N
- Formula
- C13H18ClNOSi
- SMILES
-
C[Si](C)(CCl)OCCc1c[nH]c2ccccc
12 - Molecular Weight1
- 267.83
- 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 | 0.5911 | Relay (... Calculated Property | |
| ΔfG° | 138.33 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -239.62 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 89.92 | kJ/mol | Relay (... Calculated Property |
| IE | 8.09 | eV | Relay (... Calculated Property |
| log10WS | -3.51 | Relay (... Calculated Property | |
| logPoct/wat | 3.228 | Crippen Calculated Property | |
| Pc | 2144.23 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [2131.00; 2131.00] |
|
|
| Inp | 2131.00 | NIST | |
| Inp | 2131.00 | NIST | |
| Tboil | 624.43 | K | Relay (... Calculated Property |
| Tc | 868.41 | K | Relay (... Calculated Property |
| Tfus | 317.22 | K | Relay (... Calculated Property |
| Vc | 0.756 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 3-(2-Hydroxyethyl)indole, chloromethyldimethylsilyl ether.
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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