- InChI
- InChI=1S/C17H19NO4/c1-18-7-6-16-13-9-2-3-10(19)14(13)22-15(16)11(20)4-5-17(16,21)12(18)8-9/h2-3,12,15,19,21H,4-8H2,1H3
- InChI Key
- UQCNKQCJZOAFTQ-UHFFFAOYSA-N
- Formula
- C17H19NO4
- SMILES
-
CN1CCC23c4c5ccc(O)c4OC2C(=O)CC
C3(O)C1C5 - Molecular Weight1
- 301.34
- CAS
- 76-41-5
- Other Names
-
- 7,8-Dihydro-14-hydroxymorphinone
- Morphinan-6-one, 4,5-epoxy-3,14-dihydroxy-17-methyl-, (5«alpha»)-
- Morphinan-6-one, 4,5«alpha»-epoxy-3,14-dihydroxy-17-methyl-
- (14S)-14-Hydroxydihydromorphinone
- Dihydro-14-hydroxymorphinone
- Dihydrohydroxymorphinone
- Numorphan
- 14-Hydroxydihydromorphinone
- Morphinone, dihydro-14-hydroxy-
- Morphinan-6-one, 3,14-dihydroxy-4,5-«alpha»-epoxy-17-methyl-
- 3,14-Dihydroxy-4,5-«alpha»-epoxy-17-methylmorphinan-6-one
- 4,5«alpha»-Epoxy-3,14-dihydroxy-17-methylmorphinan-6-one
- Dihydroxymorphinone
- NSC 19045
- Oxymorphine
- Dihydro-14-hydroxymorphinonel 14-hydroxydihydromorphinone
- 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 | 0.7694 | Relay (1.0) Calculated Property | |
| ΔfG° | -210.63 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -423.40 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 128.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.80 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.49 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.745 | Crippen Calculated Property | |
| McVol | 212.350 | ml/mol | McGowan Calculated Property |
| Pc | 2468.68 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2520.00; 2552.00] |
|
|
| Inp | 2550.00 | NIST | |
| Inp | 2552.00 | NIST | |
| Inp | 2520.00 | NIST | |
| Inp | 2532.00 | NIST | |
| Inp | 2550.00 | NIST | |
| Inp | 2552.00 | NIST | |
| Inp | 2532.00 | NIST | |
| Tboil | 637.11 | K | Relay (1.0) Calculated Property |
| Tc | 1029.01 | K | Relay (1.0) Calculated Property |
| Tfus | 472.28 | K | Relay (1.0) Calculated Property |
| Vc | 0.798 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Oxymorphone.
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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