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| CAS No.: | 850-57-7 |
|---|---|
| Name: | THEBAINE HYDROCHLORIDE |
| Molecular Structure: | |
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| Formula: | C19H21NO3•ClH |
| Molecular Weight: | 347.842 |
| Density: | g/cm3 |
| Boiling Point: | 467.6°Cat760mmHg |
| Flash Point: | 141°C |
| Safety: | Poison by intravenous, subcutaneous, and intraperitoneal routes. An experimental teratogen. When heated to decomposition it emits toxic fumes of NOx and HCl. |
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Chemistry
IUPAC Name: (5alpha)-3,6-Dimethoxy-17-methyl-6,7,8,14-tetradehydro-4,5-epoxymorphinan hydrochloride
Synonyms of Thebaine hydrochloride (CAS NO.850-57-7) : 6,7,8,14-Tetradehydro-4,5-alpha-epoxy-3,6-dimethoxy-17-methylmorphinan hydrochloride ; Thebain hydrochlorid ; Thebaine HCl ; Thebaine hydrochloride ; (5alpha)-6,7,8,14-Tetradehydro-4,5-epoxy-3,6-dimethoxy-17-methylmorphinan hydrochloride ; Morphinan, 6,7,8,14-tetradehydro-4,5-alpha-epoxy-3,6-dimethoxy-17-methyl-, hydrochloride ; Morphinan, 6,7,8,14-tetradehydro-4,5alpha-epoxy-3,6-dimethoxy-17-methyl-, hydrochloride (8CI)
InChI: InChI=1/C19H21NO3.ClH/c1-20-9-8-19-12-5-7-15(22-3)18(19)23-17-14(21-2)6-4-11(16(17)19)10-13(12)20;/h4-7,13,18H,8-10H2,1-3H3;1H/t13-,18+,19+;/m1./s1
CAS NO: 850-57-7
Molecular Formula:C19H22ClNO3
Molecular Weight :347.8359
Molecular Structure :.png)
Flash Point: 141 °C
Enthalpy of Vaporization: 72.97 kJ/mol
Boiling Point: 467.6 °C at 760 mmHg
Vapour Pressure: 6.4E-09 mmHg at 25°C
Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| guinea pig | LDLo | intraarterial | 80mg/kg (80mg/kg) | Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 131, Pg. 171, 1928. | |
| guinea pig | LDLo | intravenous | 55mg/kg (55mg/kg) | Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 131, Pg. 171, 1928. | |
| mouse | LD50 | intraperitoneal | 25mg/kg (25mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: IRRITABILITY | Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 61, Pg. 396, 1965. |
| mouse | LD50 | subcutaneous | 31mg/kg (31mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: IRRITABILITY | Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 61, Pg. 396, 1965. |
| rabbit | LD50 | intravenous | 3351ug/kg (3.351mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY) BEHAVIORAL: ATAXIA | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 132, Pg. 255, 1961. |
| rabbit | LDLo | subcutaneous | 9741ug/kg (9.741mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Journal of Pharmacology and Experimental Therapeutics. Vol. 66, Pg. 182, 1939. |
Safety Profile
Poison by intravenous, subcutaneous, and intraperitoneal routes. An experimental teratogen. When Thebaine hydrochloride (CAS NO.850-57-7) is heated to decomposition, it emits toxic fumes of NOx and HCl.