- InChI
- InChI=1S/C10H19NO/c12-8-9-4-3-7-11-6-2-1-5-10(9)11/h9-10,12H,1-8H2/t9-,10?/m0/s1
- InChI Key
- HDVAWXXJVMJBAR-RGURZIINSA-N
- Formula
- C10H19NO
- SMILES
- OCC1CCCN2CCCCC12
- Molecular Weight1
- 169.26
- CAS
- 486-71-5
- Other Names
-
- 1-Epilupinine
- (+)-Epilupinine
- Epi-Lupinine
- 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 | 0.5786 | Relay (1.0) Calculated Property | |
| ΔfG° | 29.73 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -252.94 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 84.60 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.74 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.31 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.243 | Crippen Calculated Property | |
| McVol | 145.890 | ml/mol | McGowan Calculated Property |
| Pc | 2873.49 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1400.00; 1418.00] |
|
|
| Inp | 1415.00 | NIST | |
| Inp | Outlier 1400.00 | NIST | |
| Inp | 1418.00 | NIST | |
| Inp | 1415.00 | NIST | |
| Inp | 1415.00 | NIST | |
| Inp | 1416.00 | NIST | |
| Tboil | 531.71 | K | Relay (1.0) Calculated Property |
| Tc | 797.96 | K | Relay (1.0) Calculated Property |
| Tfus | 384.25 | K | Relay (1.0) Calculated Property |
| Vc | 0.499 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2H-Quinolizine-1-methanol, octahydro-, (1S-cis)-.
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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Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.