- InChI
- InChI=1S/C23H36O4Si/c1-7-8-9-10-11-12-15-18-26-21(24)19-16-13-14-17-20(19)22(25)27-28(5,6)23(2,3)4/h11-14,16-17H,7-10,15,18H2,1-6H3/b12-11-
- InChI Key
- KZEGMMGPPBSCLD-QXMHVHEDSA-N
- Formula
- C23H36O4Si
- SMILES
-
CCCCCC=CCCOC(=O)c1ccccc1C(=O)O
[Si](C)(C)C(C)(C)C - Molecular Weight1
- 404.62
- Other Names
-
- 1,2-Benzenedicarboxylic acid, (Z)-non-3-enyl 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 | 0.9043 | Relay (1.0) Calculated Property | |
| ΔfG° | -207.47 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -916.80 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 92.86 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.83 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.82 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.532 | Crippen Calculated Property | |
| Pc | 910.18 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2530.00 | NIST | |
| Tboil | 644.10 | K | Relay (1.0) Calculated Property |
| Tc | 862.19 | K | Relay (1.0) Calculated Property |
| Tfus | 267.39 | K | Relay (1.0) Calculated Property |
| Vc | 1.245 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to tert-Butyldimethylsilyl (Z)-non-3-enyl 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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