- InChI
- InChI=1S/C16H27BrOSi/c1-19(2,15-16-11-7-6-8-12-16)18-14-10-5-3-4-9-13-17/h6-8,11-12H,3-5,9-10,13-15H2,1-2H3
- InChI Key
- ISMHSQMAZBXXLH-UHFFFAOYSA-N
- Formula
- C16H27BrOSi
- SMILES
- C[Si](C)(Cc1ccccc1)OCCCCCCCBr
- Molecular Weight1
- 343.37
- 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 | 0.7489 | Relay (1.0) Calculated Property | |
| ΔfG° | 90.90 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -365.46 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 84.97 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.88 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.71 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.335 | Crippen Calculated Property | |
| Pc | 1591.85 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2099.00 | NIST | |
| Tboil | 618.91 | K | Relay (1.0) Calculated Property |
| Tc | 802.22 | K | Relay (1.0) Calculated Property |
| Tfus | 265.71 | K | Relay (1.0) Calculated Property |
| Vc | 0.943 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 7-Bromo-1-heptanol, benzyldimethylsilyl 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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