- InChI
- InChI=1S/C22H32O3Si/c1-18(2)8-7-9-19(3)16-17-24-22(23)15-12-20-10-13-21(14-11-20)25-26(4,5)6/h8,10-16H,7,9,17H2,1-6H3/b15-12+,19-16-
- InChI Key
- MZPYHALLWWGKOP-PZGOMQMCSA-N
- Formula
- C22H32O3Si
- SMILES
-
CC(C)=CCCC(C)=CCOC(=O)C=Cc1ccc
(O[Si](C)(C)C)cc1 - Molecular Weight1
- 372.57
- 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 | 0.7360 | Relay (1.0) Calculated Property | |
| ΔfG° | -16.97 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -598.60 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 93.40 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.30 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.81 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.149 | Crippen Calculated Property | |
| Pc | 733.47 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2653.00; 2663.00] |
|
|
| Inp | 2653.00 | NIST | |
| Inp | 2663.00 | NIST | |
| Tboil | 649.57 | K | Relay (1.0) Calculated Property |
| Tc | 831.90 | K | Relay (1.0) Calculated Property |
| Tfus | 327.52 | K | Relay (1.0) Calculated Property |
| Vc | 1.131 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Geranyl (E)-p-coumarate, mono-TMS.
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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