- InChI
- InChI=1S/C21H37NOSi/c1-20(2)11-8-12-21(3)17-10-9-16(19(17)20)18(21)15-23-24(4,5)14-7-6-13-22/h16-19H,6-12,14-15H2,1-5H3
- InChI Key
- JYXMBCXNZBDUBI-UHFFFAOYSA-N
- Formula
- C21H37NOSi
- SMILES
-
CC1(C)CCCC2(C)C(CO[Si](C)(C)CC
CC#N)C3CCC2C31 - Molecular Weight1
- 347.61
- 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 | 0.6504 | Relay (... Calculated Property | |
| ΔfG° | 196.92 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -403.90 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 94.45 | kJ/mol | Relay (... Calculated Property |
| IE | 9.44 | eV | Relay (... Calculated Property |
| log10WS | -5.48 | Relay (... Calculated Property | |
| logPoct/wat | 6.000 | Crippen Calculated Property | |
| Pc | 1115.61 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [2341.00; 2341.00] |
|
|
| Inp | 2341.00 | NIST | |
| Inp | 2341.00 | NIST | |
| Tboil | 651.07 | K | Relay (... Calculated Property |
| Tc | 921.89 | K | Relay (... Calculated Property |
| Tfus | 346.44 | K | Relay (... Calculated Property |
| Vc | 1.117 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to (-)-Isolongifolol, (3-cyanopropyl)dimethylsilyl ether.
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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