- InChI
- InChI=1S/C13H25NOSi/c1-12-6-8-13(9-7-12)15-16(2,3)11-5-4-10-14/h12-13H,4-9,11H2,1-3H3
- InChI Key
- PMELFRPQCQLRQC-UHFFFAOYSA-N
- Formula
- C13H25NOSi
- SMILES
- CC1CCC(O[Si](C)(C)CCCC#N)CC1
- Molecular Weight1
- 239.43
- 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 | 0.5719 | Relay (... Calculated Property | |
| ΔfG° | 99.60 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -352.07 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 67.68 | kJ/mol | Relay (... Calculated Property |
| IE | 9.97 | eV | Relay (... Calculated Property |
| log10WS | -2.58 | Relay (... Calculated Property | |
| logPoct/wat | 4.091 | Crippen Calculated Property | |
| Pc | 1659.42 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | 1641.00 | NIST | |
| Tboil | 576.88 | K | Relay (... Calculated Property |
| Tc | 772.72 | K | Relay (... Calculated Property |
| Tfus | 254.96 | K | Relay (... Calculated Property |
| Vc | 0.780 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to trans-4-Methylcyclohexanol, (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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