- InChI
- InChI=1S/C7H17BO2/c1-4-5-6-7-8(9-2)10-3/h4-7H2,1-3H3
- InChI Key
- NSUBGUFXLBWGFM-UHFFFAOYSA-N
- Formula
- C7H17BO2
- SMILES
- CCCCCB(OC)OC
- Molecular Weight1
- 144.02
- 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 | 0.4814 | Relay (1.0) Calculated Property | |
| ΔfG° | -205.73 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -569.84 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 41.60 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.72 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.12 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.958 | Crippen Calculated Property | |
| Pc | 2441.48 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 968.00 | NIST | |
| Tboil | 407.70 | K | Relay (1.0) Calculated Property |
| Tc | 600.29 | K | Relay (1.0) Calculated Property |
| Tfus | 223.12 | K | Relay (1.0) Calculated Property |
| Vc | 0.508 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Borane, dimethoxy, pentyl.
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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