- InChI
- InChI=1S/C15H26N2O/c18-15-9-12(10-16-7-4-2-6-14(15)16)13-5-1-3-8-17(13)11-15/h12-14,18H,1-11H2/t12-,13-,14-,15+/m0/s1
- InChI Key
- DUUGVIKWQIWALC-ZQDZILKHSA-N
- Formula
- C15H26N2O
- SMILES
- OC12CC(CN3CCCCC31)C1CCCCN1C2
- Molecular Weight1
- 250.38
- 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.
- McVol : McGowan's characteristic volume (ml/mol).
- 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 | 0.5866 | Relay (... Calculated Property | |
| ΔfG° | 119.37 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -249.04 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 99.41 | kJ/mol | Relay (... Calculated Property |
| IE | 7.36 | eV | Relay (... Calculated Property |
| log10WS | -1.66 | Relay (... Calculated Property | |
| logPoct/wat | 1.460 | Crippen Calculated Property | |
| McVol | 204.600 | ml/mol | McGowan Calculated Property |
| Pc | 1748.30 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | 1948.00 | NIST | |
| Tboil | 613.18 | K | Relay (... Calculated Property |
| Tc | 893.78 | K | Relay (... Calculated Property |
| Tfus | 430.07 | K | Relay (... Calculated Property |
| Vc | 0.772 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 9-Hydroxysparteine.
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
- McGowan Method
- NIST Webbook
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