- InChI
- InChI=1S/C33H68O2Si/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(34)35-36(5,6)33(2,3)4/h7-31H2,1-6H3
- InChI Key
- ZKWBBRPBCNPPOA-UHFFFAOYSA-N
- Formula
- C33H68O2Si
- SMILES
-
CCCCCCCCCCCCCCCCCCCCCCCCCCC(=O
)O[Si](C)(C)C(C)(C)C - Molecular Weight1
- 524.98
- 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 | 1.3311 | Relay (1.0) Calculated Property | |
| ΔfG° | -43.24 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1128.97 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 140.54 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.10 | eV | Relay (1.0) Calculated Property |
| log10WS | -10.34 | Relay (1.0) Calculated Property | |
| logPoct/wat | 12.307 | Crippen Calculated Property | |
| Inp | [3396.00; 3396.00] |
|
|
| Inp | 3396.00 | NIST | |
| Inp | 3396.00 | NIST | |
| Tboil | 664.95 | K | Relay (1.0) Calculated Property |
| Tc | 869.00 | K | Relay (1.0) Calculated Property |
| Tfus | 324.80 | K | Relay (1.0) Calculated Property |
| Vc | 1.964 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Heptacosanoic 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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