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Name |
1,2,3,4,5,6-Hexahydro-6,11-dimethyl-3-(3-methylbut-2-enyl)-2,6-methano-3-benzazocin-8-ol hydrochloride |
EINECS | N/A |
CAS No. | 2276-52-0 | Density | N/A |
PSA | 23.47000 | LogP | 4.62250 |
Solubility | N/A | Melting Point |
N/A |
Formula | C19H27 N O . Cl H | Boiling Point | 403.5°C at 760 mmHg |
Molecular Weight | 321.93 | Flash Point | 180.8°C |
Transport Information | N/A | Appearance | N/A |
Safety | Poison by subcutaneous route. An experimental teratogen. Experimental reproductive effects. When heated to decomposition it emits toxic fumes of NOx and HCl. | Risk Codes | N/A |
Molecular Structure | Hazard Symbols | 3 | |
Synonyms |
2,6-Methano-3-benzazocin-8-ol,1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-(3-methyl-2-butenyl)-, hydrochloride(8CI,9CI) |
Empirical Formula of 1,2,3,4,5,6-Hexahydro-6,11-dimethyl-3-(3-methylbut-2-enyl)-2,6-methano-3-benzazocin-8-ol hydrochloride (CAS NO.2276-52-0): C19H28ClNO
Molecular Weight: 321.8847 g/mol
EINECS: 218-896-9
Flash Point: 180.8 °C
Enthalpy of Vaporization: 68.03 kJ/mol
Boiling Point: 403.5 °C at 760 mmHg
Vapour Pressure: 4.35E-07 mmHg at 25 °C
Structure of 1,2,3,4,5,6-Hexahydro-6,11-dimethyl-3-(3-methylbut-2-enyl)-2,6-methano-3-benzazocin-8-ol hydrochloride (CAS NO.2276-52-0):
Canonical SMILES: CC1C2CC3=C(C1(CCN2CC=C(C)C)C)C=C(C=C3)O.Cl
InChI: InChI=1S/C19H27NO.ClH/c1-13(2)7-9-20-10-8-19(4)14(3)18(20)11-15-5-6-16(21)12-17(15)19;/h5-7,12,14,18,21H,8-11H2,1-4H3;1H
InChIKey: OQGYMIIFOSJQSF-UHFFFAOYSA-N
1. | scu-mus TDLo:100 mg/kg (9D preg):TER | DGDFA5 Development, Growth and Differentiation. 22 (1980),61. | ||
2. | orl-wmn TDLo:50 mg/kg | IJMDAI Israel Journal of Medical Sciences. 22 (1986),385. IJMDAI Israel Journal of Medical Sciences. 22 (1986),385. | ||
3. | scu-mus LD50:126 mg/kg |
Poison by subcutaneous route. An experimental teratogen. Experimental reproductive effects. When heated to decomposition 1,2,3,4,5,6-Hexahydro-6,11-dimethyl-3-(3-methylbut-2-enyl)-2,6-methano-3-benzazocin-8-ol hydrochloride (CAS NO.2276-52-0) emits toxic fumes of NOx and HCl.
1,2,3,4,5,6-Hexahydro-6,11-dimethyl-3-(3-methylbut-2-enyl)-2,6-methano-3-benzazocin-8-ol hydrochloride , its cas register number is 2276-52-0. It also can be called 2,6-Methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-(3-methyl-2-butenyl)-, hydrochloride .