- InChI
- InChI=1S/C16H23ClO4Si/c1-16(2,3)22(4,5)21-15(19)13-9-7-6-8-12(13)14(18)20-11-10-17/h6-9H,10-11H2,1-5H3
- InChI Key
- IXBQBMPHCRFSDG-UHFFFAOYSA-N
- Formula
- C16H23ClO4Si
- SMILES
-
CC(C)(C)[Si](C)(C)OC(=O)c1cccc
c1C(=O)OCCCl - Molecular Weight1
- 342.89
- Other Names
-
- 1,2-Benzenedicarboxylic acid, 2-chloroethyl tert-butyldimethylsilyl ester
- 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 | 0.7692 | Relay (1.0) Calculated Property | |
| ΔfG° | -337.92 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -871.05 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 77.67 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.41 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.39 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.244 | Crippen Calculated Property | |
| Pc | 1598.18 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2105.00; 2105.00] |
|
|
| Inp | 2105.00 | NIST | |
| Inp | 2105.00 | NIST | |
| Tboil | 603.86 | K | Relay (1.0) Calculated Property |
| Tc | 838.31 | K | Relay (1.0) Calculated Property |
| Tfus | 310.00 | K | Relay (1.0) Calculated Property |
| Vc | 0.938 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to tert-Butyldimethylsilyl 2-chloroethyl phthalate.
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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