- InChI
- InChI=1S/C15H24N2O2/c18-12-4-5-13-11-6-10(7-16(13)9-12)14-2-1-3-15(19)17(14)8-11/h10-14,18H,1-9H2
- InChI Key
- JZFWYXLNISKIRH-UHFFFAOYSA-N
- Formula
- C15H24N2O2
- SMILES
-
O=C1CCCC2C3CC(CN12)C1CCC(O)CN1
C3 - Molecular Weight1
- 264.36
- 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 | 0.6520 | Relay (1.0) Calculated Property | |
| ΔfG° | 43.06 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -428.64 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 125.30 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.69 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.92 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.842 | Crippen Calculated Property | |
| McVol | 206.170 | ml/mol | McGowan Calculated Property |
| Pc | 1608.71 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2345.00 | NIST | |
| Tboil | 664.26 | K | Relay (1.0) Calculated Property |
| Tc | 958.71 | K | Relay (1.0) Calculated Property |
| Tfus | 484.15 | K | Relay (1.0) Calculated Property |
| Vc | 0.772 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
![7,14-Methano-4H,6H-dipyrido[1,2-a:1',2'-e][1,5]diazocin-4-one, dodecahydro-2-hydroxy-, [2S-(2«alpha»,7«alpha»,7a«beta»,14«alpha»,14a«alpha»)]-.](data:image/png;base64,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)
Find more compounds similar to 13-Epihydroxyisolupanine.
Sources
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- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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