O-Desmethyl tramadol hydrochloride
Grundinformationen
- CAS
148262-77-5- Standard-SMILES
CN(C)C[C@H]1CCCC[C@]1(O)c1cccc(O)c1.Cl- InChIKey
IRGWVAWLHXDKIX-PBCQUBLHSA-N- Summenformel
- C15H24ClNO2
- Durchschnittliche Molmasse
- 285,81 g/mol
- Monoisotopische Masse
- 285,1495567
Namen und Bezeichner
- Bevorzugter Name
- O-Desmethyl tramadol hydrochloride
- IUPAC
- 3-[(1R,2R)-2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]phenol;hydrochloride
- Englischer Name
- O-DesMethyl TraMadol Hydrochloride
- Summenformel
- C15H24ClNO2
- Molmasse
- 285.81
Namen und Synonyme
O-Desmethyl Tramadol Hydrochloride185453-02-5O-demethyltramadol hydrochlorideXL5VDC061EPhenol, 3-(2-((dimethylamino)methyl)-1-hydroxycyclohexyl)-, hydrochloride, cis-Phenol, 3-((1R,2R)-2-((dimethylamino)methyl)-1-hydroxycyclohexyl)-, hydrochloride (1:1), rel-Phenol, 3-((1R,2R)-2-((dimethylamino)methyl)-1-hydroxycyclohexyl)-, hydrochloride, rel-RefChem:202373148262-77-5O-Desmethyltramadol hydrochloride3-[(1R,2R)-2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]phenol;hydrochlorideO-Desmethyltramadol HCl
Weitere Namen anzeigen
Tramadol EP Impurity DTramadol EP Impurity D HClTraMadol Hydrochloride IMpurity-D(EP)O-Desmethyl-cis-tramadol (hydrochloride)Tramadol Impurity 4（Tramadol EP Impurity D）O-DesMethyl TraMadol Hydrochloride ImpurityTramadol EP Impurity D HCl ( and Enantiomer)O-Desmethyl-cis-tramadol (hydrochloride) (CRM)(±)-(cis)-O-Desmethyl cis-tramadol hydrochloride
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 43,7 Ų
- H-Brücken-Donoren
- 3
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 19
- Formalladung
- 0
- Komplexität
- 269
Physikochemische Eigenschaften
- Schmelzpunkt
- 219 · 219-221C
- storage temp.
- -20 °C · -20°C Freezer
- Löslichkeit
- Methanol (Slightly), Water (Slightly)
- Aggregatzustand
- Solid
- Farbe
- White to off-white
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P270, P271, P273, P301+P316, P304+P340, P319, P321, P330, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Sicherheitsdaten
- wgk
- 3
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological ClassificationCompounds with activity like OPIATE ALKALOIDS, acting at OPIOID RECEPTORS. Properties include induction of ANALGESIA or NARCOSIS.
Anwendungen
BeschreibungO-Desmethyl-cis-tramadol (hydrochloride) (CRM) (Item No. 18751) is a certified reference material that is structurally categorized as an opioid. It is the main metabolite of cis-tramadol (Item Nos. ISO60149 | 15919). O-Desmethyl-cis-tramadol has ~400-500-fold higher affinity for μ-opioid receptors than the parent compound. However, O-desmethyl-cis-tramadol poorly suppresses the human serotonin transporter, unlike cis-tramadol. This product is intended for research and forensic applications.
VerwendenA metabolite of Tramadol, an analgesic.
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