- InChI
- InChI=1S/C17H24O4Si/c1-5-6-7-10-13-20-16(18)14-11-8-9-12-15(14)17(19)21-22(2,3)4/h6-9,11-12H,5,10,13H2,1-4H3/b7-6-
- InChI Key
- XUSGDHULPNXLDO-SREVYHEPSA-N
- Formula
- C17H24O4Si
- SMILES
-
CCC=CCCOC(=O)c1ccccc1C(=O)O[Si
](C)(C)C - Molecular Weight1
- 320.46
- Other Names
-
- 1,2-Benzenedicarboxylic acid, (Z)-Hex-3-enyl 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 | 0.7485 | Relay (... Calculated Property | |
| ΔfG° | -270.49 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -809.69 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 82.32 | kJ/mol | Relay (... Calculated Property |
| IE | 8.98 | eV | Relay (... Calculated Property |
| log10WS | -4.19 | Relay (... Calculated Property | |
| logPoct/wat | 4.191 | Crippen Calculated Property | |
| Pc | 1073.50 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [2022.00; 2022.00] |
|
|
| Inp | 2022.00 | NIST | |
| Inp | 2022.00 | NIST | |
| Tboil | 606.38 | K | Relay (... Calculated Property |
| Tc | 791.35 | K | Relay (... Calculated Property |
| Tfus | 241.86 | K | Relay (... Calculated Property |
| Vc | 0.957 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to (Z)-Hex-3-enyl 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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