- InChI
- InChI=1S/C13H23NOSi/c1-5-9-13(10-6-2)15-16(3,4)12-8-7-11-14/h5-6,13H,1-2,7-10,12H2,3-4H3
- InChI Key
- XDKXUXGYCNGKMQ-UHFFFAOYSA-N
- Formula
- C13H23NOSi
- SMILES
- C=CCC(CC=C)O[Si](C)(C)CCCC#N
- Molecular Weight1
- 237.41
- 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 | 0.5592 | Relay (... Calculated Property | |
| ΔfG° | 190.68 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -221.41 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 66.68 | kJ/mol | Relay (... Calculated Property |
| IE | 9.74 | eV | Relay (... Calculated Property |
| log10WS | -1.86 | Relay (... Calculated Property | |
| logPoct/wat | 4.033 | Crippen Calculated Property | |
| Pc | 1641.23 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1525.00; 1525.00] |
|
|
| Inp | 1525.00 | NIST | |
| Inp | 1525.00 | NIST | |
| Tboil | 555.81 | K | Relay (... Calculated Property |
| Tc | 719.14 | K | Relay (... Calculated Property |
| Tfus | 238.31 | K | Relay (... Calculated Property |
| Vc | 0.738 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 1,6-Heptadien-4-ol, (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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