- InChI
- InChI=1S/C26H46OSi/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-25-22-20-23-26(24-25)27-28(2,3)4/h10-11,20,22-24H,5-9,12-19,21H2,1-4H3/b11-10-
- InChI Key
- ZPSDLHGBWIGWRZ-KHPPLWFESA-N
- Formula
- C26H46OSi
- SMILES
-
CCCCCCC=CCCCCCCCCCc1cccc(O[Si]
(C)(C)C)c1 - Molecular Weight1
- 402.73
- 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 | 0.9737 | Relay (... Calculated Property | |
| ΔfG° | 168.58 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -561.16 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 113.22 | kJ/mol | Relay (... Calculated Property |
| IE | 8.63 | eV | Relay (... Calculated Property |
| log10WS | -8.30 | Relay (... Calculated Property | |
| logPoct/wat | 9.090 | Crippen Calculated Property | |
| Pc | 310.05 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [2679.20; 2679.20] |
|
|
| Inp | 2679.20 | NIST | |
| Inp | 2679.20 | NIST | |
| Tboil | 657.95 | K | Relay (... Calculated Property |
| Tc | 835.34 | K | Relay (... Calculated Property |
| Tfus | 281.08 | K | Relay (... Calculated Property |
| Vc | 1.428 | m3/kmol | Relay (... Calculated Property |
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)
Find more compounds similar to Cardanol C17:1 (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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