- InChI
- InChI=1S/C19H29ClO4Si/c1-25(2,3)24-19(22)17-13-9-8-12-16(17)18(21)23-15-11-7-5-4-6-10-14-20/h8-9,12-13H,4-7,10-11,14-15H2,1-3H3
- InChI Key
- BRVPUSOIOFPHCP-UHFFFAOYSA-N
- Formula
- C19H29ClO4Si
- SMILES
-
C[Si](C)(C)OC(=O)c1ccccc1C(=O)
OCCCCCCCCCl - Molecular Weight1
- 384.97
- Other Names
-
- 1,2-Benzenedicarboxylic acid, 8-chlorooctyl trimethylsilyl 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 | 0.9773 | Relay (... Calculated Property | |
| ΔfG° | -324.18 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -947.28 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 98.31 | kJ/mol | Relay (... Calculated Property |
| IE | 9.53 | eV | Relay (... Calculated Property |
| log10WS | -5.61 | Relay (... Calculated Property | |
| logPoct/wat | 5.414 | Crippen Calculated Property | |
| Pc | 929.14 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [2521.00; 2521.00] |
|
|
| Inp | 2521.00 | NIST | |
| Inp | 2521.00 | NIST | |
| Tboil | 631.99 | K | Relay (... Calculated Property |
| Tc | 849.99 | K | Relay (... Calculated Property |
| Tfus | 275.35 | K | Relay (... Calculated Property |
| Vc | 1.141 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 8-Chlorooctyl trimethylsilyl 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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