- InChI
- InChI=1S/C35H72O2Si/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34(36)37-38(5,6)35(2,3)4/h7-33H2,1-6H3
- InChI Key
- TUMHZMMEIQPMRA-UHFFFAOYSA-N
- Formula
- C35H72O2Si
- SMILES
-
CCCCCCCCCCCCCCCCCCCCCCCCCCCCC(
=O)O[Si](C)(C)C(C)(C)C - Molecular Weight1
- 553.03
- 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.
- 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 | 1.4012 | Relay (1.0) Calculated Property | |
| ΔfG° | -26.98 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1170.62 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 148.69 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.17 | eV | Relay (1.0) Calculated Property |
| log10WS | -10.89 | Relay (1.0) Calculated Property | |
| logPoct/wat | 13.087 | Crippen Calculated Property | |
| Inp | 3600.00 | NIST | |
| Tboil | 677.70 | K | Relay (1.0) Calculated Property |
| Tc | 880.74 | K | Relay (1.0) Calculated Property |
| Tfus | 328.49 | K | Relay (1.0) Calculated Property |
| Vc | 2.073 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Nonacosanoic acid, TBDMS.
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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